CID 3871137

4-[(3-methylpiperidin-1-yl)methyl]-1,3-thiazol-2-amine

Structural Information

Molecular Formula
C10H17N3S
SMILES
CC1CCCN(C1)CC2=CSC(=N2)N
InChI
InChI=1S/C10H17N3S/c1-8-3-2-4-13(5-8)6-9-7-14-10(11)12-9/h7-8H,2-6H2,1H3,(H2,11,12)
InChIKey
FIQGFRSJRWEWCC-UHFFFAOYSA-N
Compound name
4-[(3-methylpiperidin-1-yl)methyl]-1,3-thiazol-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

6
References

2
Patents

211.11432 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 212.12160 146.7
[M+Na]+ 234.10354 153.7
[M-H]- 210.10704 150.2
[M+NH4]+ 229.14814 164.9
[M+K]+ 250.07748 150.2
[M+H-H2O]+ 194.11158 139.2
[M+HCOO]- 256.11252 161.8
[M+CH3COO]- 270.12817 158.3
[M+Na-2H]- 232.08899 146.2
[M]+ 211.11377 143.6
[M]- 211.11487 143.6
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe