CID 3822735

2-methyl-1,2,3,4-tetrahydroquinolin-8-ol

Structural Information

Molecular Formula
C10H13NO
SMILES
CC1CCC2=C(N1)C(=CC=C2)O
InChI
InChI=1S/C10H13NO/c1-7-5-6-8-3-2-4-9(12)10(8)11-7/h2-4,7,11-12H,5-6H2,1H3
InChIKey
PDEJYMBYUUOXQA-UHFFFAOYSA-N
Compound name
2-methyl-1,2,3,4-tetrahydroquinolin-8-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

21
Patents

163.09972 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 164.10700 134.3
[M+Na]+ 186.08894 141.8
[M-H]- 162.09244 134.7
[M+NH4]+ 181.13354 153.7
[M+K]+ 202.06288 137.8
[M+H-H2O]+ 146.09698 128.5
[M+HCOO]- 208.09792 151.5
[M+CH3COO]- 222.11357 174.2
[M+Na-2H]- 184.07439 140.9
[M]+ 163.09917 129.5
[M]- 163.10027 129.5
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