CID 165993357

2-hydroxy-6-oxo-n-phenylcyclohex-1-ene-1-carboxamide

Structural Information

Molecular Formula
C13H13NO3
SMILES
C1CC(=C(C(=O)C1)C(=O)NC2=CC=CC=C2)O
InChI
InChI=1S/C13H13NO3/c15-10-7-4-8-11(16)12(10)13(17)14-9-5-2-1-3-6-9/h1-3,5-6,15H,4,7-8H2,(H,14,17)
InChIKey
RAHGMMUFYKDPNV-UHFFFAOYSA-N
Compound name
2-hydroxy-6-oxo-N-phenylcyclohexene-1-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

231.08954 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 232.09682 149.6
[M+Na]+ 254.07876 155.3
[M-H]- 230.08226 154.8
[M+NH4]+ 249.12336 166.2
[M+K]+ 270.05270 152.2
[M+H-H2O]+ 214.08680 142.5
[M+HCOO]- 276.08774 171.0
[M+CH3COO]- 290.10339 189.2
[M+Na-2H]- 252.06421 153.6
[M]+ 231.08899 145.9
[M]- 231.09009 145.9
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

No patent data available for this compound.