CID 441154

5,6-dihydroxy-3-methyl-5,6-dihydroquinolin-2(1h)-one

Structural Information

Molecular Formula
C10H11NO3
SMILES
CC1=CC2=C(C=CC(C2O)O)NC1=O
InChI
InChI=1S/C10H11NO3/c1-5-4-6-7(11-10(5)14)2-3-8(12)9(6)13/h2-4,8-9,12-13H,1H3,(H,11,14)
InChIKey
SQVOTYNRTIAIBT-UHFFFAOYSA-N
Compound name
5,6-dihydroxy-3-methyl-5,6-dihydro-1H-quinolin-2-one
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

2
References

6
Patents

193.0739 Da
Monoisotopic Mass

-1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 194.08118 139.0
[M+Na]+ 216.06312 152.1
[M+NH4]+ 211.10772 146.5
[M+K]+ 232.03706 146.9
[M-H]- 192.06662 139.5
[M+Na-2H]- 214.04857 143.5
[M]+ 193.07335 140.8
[M]- 193.07445 140.8
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