CID 12237458

6-methylquinolin-2(1h)-one

Structural Information

Molecular Formula
C10H9NO
SMILES
CC1=CC2=C(C=C1)NC(=O)C=C2
InChI
InChI=1S/C10H9NO/c1-7-2-4-9-8(6-7)3-5-10(12)11-9/h2-6H,1H3,(H,11,12)
InChIKey
LOUXUHOSYWFSHV-UHFFFAOYSA-N
Compound name
6-methyl-1H-quinolin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

350
Patents

159.06842 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 160.07570 130.3
[M+Na]+ 182.05764 145.8
[M+NH4]+ 177.10224 139.8
[M+K]+ 198.03158 138.2
[M-H]- 158.06114 133.0
[M+Na-2H]- 180.04309 138.5
[M]+ 159.06787 133.4
[M]- 159.06897 133.4
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