CID 169153

30389-33-4

Structural Information

Molecular Formula
C9H9NO2
SMILES
C1CC(=O)NC2=C1C(=CC=C2)O
InChI
InChI=1S/C9H9NO2/c11-8-3-1-2-7-6(8)4-5-9(12)10-7/h1-3,11H,4-5H2,(H,10,12)
InChIKey
UTTJAIFHRUAFED-UHFFFAOYSA-N
Compound name
5-hydroxy-3,4-dihydro-1H-quinolin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

287
Patents

163.06332 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 164.07060 131.5
[M+Na]+ 186.05254 139.6
[M-H]- 162.05604 132.1
[M+NH4]+ 181.09714 150.7
[M+K]+ 202.02648 135.9
[M+H-H2O]+ 146.06058 125.8
[M+HCOO]- 208.06152 149.5
[M+CH3COO]- 222.07717 172.4
[M+Na-2H]- 184.03799 138.8
[M]+ 163.06277 127.2
[M]- 163.06387 127.2
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