CID 90352796

6,6-dimethyl-5,6,7,8-tetrahydroquinolin-5-one hydrochloride

Structural Information

Molecular Formula
C11H13NO
SMILES
CC1(CCC2=C(C1=O)C=CC=N2)C
InChI
InChI=1S/C11H13NO/c1-11(2)6-5-9-8(10(11)13)4-3-7-12-9/h3-4,7H,5-6H2,1-2H3
InChIKey
QGJSKZRBNAABTG-UHFFFAOYSA-N
Compound name
6,6-dimethyl-7,8-dihydroquinolin-5-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

7
Patents

175.09972 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 176.10700 137.7
[M+Na]+ 198.08894 151.8
[M+NH4]+ 193.13354 148.7
[M+K]+ 214.06288 142.4
[M-H]- 174.09244 140.5
[M+Na-2H]- 196.07439 145.8
[M]+ 175.09917 140.7
[M]- 175.10027 140.7
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe