CCS search

Match a measured Collision Cross Section against PubChemLite's predictions within a tolerance window, for a chosen ionization mode or a specific adduct. Optionally narrow further by adding a measured m/z with its own Da or ppm tolerance — a compound matches only when the same adduct fits both the CCS and m/z windows.

Search for

Looking for compounds with CCS between 132.890 and 141.110 Ų in positive mode, with m/z between 163.1222 and 163.1238 Da .

179 compounds found. Download CSV ↓ up to 10 000 rows

Sorted by annotation hits → literature count → patent count. Most-documented compounds appear first.

3-(piperidin-1-yl)pyridine

2D structure of 3-(piperidin-1-yl)pyridine
[M+H]+
135.40 Ų
Annotation hits
1
Literature count
0
Patent count
436
Formula
C10H14N2
Mass
162.11569 Da

14097-40-6

2D structure of 14097-40-6
[M+H]+
134.30 Ų
Annotation hits
1
Literature count
0
Patent count
248
Formula
C10H14N2
Mass
162.11569 Da

3-[2-(dimethylamino)ethoxy]aniline

2D structure of 3-[2-(dimethylamino)ethoxy]aniline
[M+H-H2O]+
133.30 Ų
Annotation hits
1
Literature count
0
Patent count
200
Formula
C10H16N2O
Mass
180.12627 Da

3-(piperidin-4-yl)pyridine

2D structure of 3-(piperidin-4-yl)pyridine
[M+H]+
136.00 Ų
Annotation hits
1
Literature count
0
Patent count
185
Formula
C10H14N2
Mass
162.11569 Da

2-(piperidin-2-yl)pyridine

2D structure of 2-(piperidin-2-yl)pyridine
[M+H]+
136.00 Ų
Annotation hits
1
Literature count
0
Patent count
185
Formula
C10H14N2
Mass
162.11569 Da

1346575-64-1

2D structure of 1346575-64-1
[M+H-H2O]+
133.90 Ų
Annotation hits
1
Literature count
0
Patent count
183
Formula
C10H16N2O
Mass
180.12627 Da

1-phenylpyrrolidin-3-amine

2D structure of 1-phenylpyrrolidin-3-amine
[M+H]+
134.60 Ų
Annotation hits
1
Literature count
0
Patent count
166
Formula
C10H14N2
Mass
162.11569 Da

304690-94-6

2D structure of 304690-94-6
[M+H]+
134.30 Ų
Annotation hits
1
Literature count
0
Patent count
164
Formula
C10H14N2
Mass
162.11569 Da

1202-00-2

2D structure of 1202-00-2
[M+H-H2O]+
133.30 Ų
Annotation hits
1
Literature count
0
Patent count
104
Formula
C10H16N2O
Mass
180.12627 Da

N-phenylpyrrolidin-3-amine

2D structure of N-phenylpyrrolidin-3-amine
[M+H]+
134.30 Ų
Annotation hits
1
Literature count
0
Patent count
101
Formula
C10H14N2
Mass
162.11569 Da

1,2,3,4-tetrahydronaphthalene-1,7-diamine dihydrochloride

2D structure of 1,2,3,4-tetrahydronaphthalene-1,7-diamine dihydrochloride
[M+H]+
133.00 Ų
Annotation hits
1
Literature count
0
Patent count
85
Formula
C10H14N2
Mass
162.11569 Da

N-methyl-5,6,7,8-tetrahydroquinolin-8-amine

2D structure of N-methyl-5,6,7,8-tetrahydroquinolin-8-amine
[M+H]+
133.40 Ų
Annotation hits
1
Literature count
0
Patent count
83
Formula
C10H14N2
Mass
162.11569 Da

2-(piperidin-3-yl)pyridine dihydrochloride

2D structure of 2-(piperidin-3-yl)pyridine dihydrochloride
[M+H]+
136.00 Ų
Annotation hits
1
Literature count
0
Patent count
79
Formula
C10H14N2
Mass
162.11569 Da

1-methyl-1,2,3,4-tetrahydroquinolin-6-amine

2D structure of 1-methyl-1,2,3,4-tetrahydroquinolin-6-amine
[M+H]+
134.30 Ų
Annotation hits
1
Literature count
0
Patent count
76
Formula
C10H14N2
Mass
162.11569 Da

1-methyl-1,2,3,4-tetrahydroquinolin-4-amine

2D structure of 1-methyl-1,2,3,4-tetrahydroquinolin-4-amine
[M+H]+
134.30 Ų
Annotation hits
1
Literature count
0
Patent count
73
Formula
C10H14N2
Mass
162.11569 Da

4-(propan-2-yl)benzene-1-carboximidamide hydrochloride

2D structure of 4-(propan-2-yl)benzene-1-carboximidamide hydrochloride
[M+H]+
136.70 Ų
Annotation hits
1
Literature count
0
Patent count
63
Formula
C10H14N2
Mass
162.11569 Da

647824-51-9

2D structure of 647824-51-9
[M+H-H2O]+
134.60 Ų
Annotation hits
1
Literature count
0
Patent count
51
Formula
C10H16N2O
Mass
180.12627 Da

2-methyl-1,2,3,4-tetrahydroisoquinolin-4-amine

2D structure of 2-methyl-1,2,3,4-tetrahydroisoquinolin-4-amine
[M+H]+
134.30 Ų
Annotation hits
1
Literature count
0
Patent count
50
Formula
C10H14N2
Mass
162.11569 Da

143543-67-3

2D structure of 143543-67-3
[M+H]+
134.50 Ų
Annotation hits
1
Literature count
0
Patent count
48
Formula
C10H14N2
Mass
162.11569 Da

524674-44-0

2D structure of 524674-44-0
[M+H]+
135.70 Ų
Annotation hits
1
Literature count
0
Patent count
47
Formula
C10H14N2
Mass
162.11569 Da

4-[(dimethylamino)methyl]-2-methoxyaniline

2D structure of 4-[(dimethylamino)methyl]-2-methoxyaniline
[M+H-H2O]+
133.50 Ų
Annotation hits
1
Literature count
0
Patent count
47
Formula
C10H16N2O
Mass
180.12627 Da

2-methyl-1,2,3,4-tetrahydroisoquinolin-5-amine dihyd...

2D structure of 2-methyl-1,2,3,4-tetrahydroisoquinolin-5-amine dihydrochloride
[M+H]+
134.30 Ų
Annotation hits
1
Literature count
0
Patent count
44
Formula
C10H14N2
Mass
162.11569 Da

N,n,n'-trimethylbenzenecarboximidamide monohydrochloride

2D structure of N,n,n'-trimethylbenzenecarboximidamide monohydrochloride
[M+H]+
136.00 Ų
Annotation hits
1
Literature count
0
Patent count
41
Formula
C10H14N2
Mass
162.11569 Da

106366-28-3

2D structure of 106366-28-3
[M+H]+
135.70 Ų
Annotation hits
1
Literature count
0
Patent count
40
Formula
C10H14N2
Mass
162.11569 Da

101832-33-1

2D structure of 101832-33-1
[M+H-H2O]+
133.50 Ų
Annotation hits
1
Literature count
0
Patent count
39
Formula
C10H16N2O
Mass
180.12627 Da

2,3-dimethyl-1,2,3,4-tetrahydroquinoxaline

2D structure of 2,3-dimethyl-1,2,3,4-tetrahydroquinoxaline
[M+H]+
136.50 Ų
Annotation hits
1
Literature count
0
Patent count
33
Formula
C10H14N2
Mass
162.11569 Da

N-cyclopentylpyridin-2-amine

2D structure of N-cyclopentylpyridin-2-amine
[M+H]+
134.00 Ų
Annotation hits
1
Literature count
0
Patent count
32
Formula
C10H14N2
Mass
162.11569 Da

2-methyl-5-(pyrrolidin-2-yl)pyridine

2D structure of 2-methyl-5-(pyrrolidin-2-yl)pyridine
[M+H]+
135.70 Ų
Annotation hits
1
Literature count
0
Patent count
32
Formula
C10H14N2
Mass
162.11569 Da

[2-(tert-butoxy)pyridin-3-yl]methanamine

2D structure of [2-(tert-butoxy)pyridin-3-yl]methanamine
[M+H-H2O]+
135.00 Ų
Annotation hits
1
Literature count
0
Patent count
31
Formula
C10H16N2O
Mass
180.12627 Da

2,2-dimethyl-1,2,3,4-tetrahydroquinoxaline

2D structure of 2,2-dimethyl-1,2,3,4-tetrahydroquinoxaline
[M+H]+
136.80 Ų
Annotation hits
1
Literature count
0
Patent count
29
Formula
C10H14N2
Mass
162.11569 Da