CID 105688

N-(3,5-dihydroxyphenyl)benzamide

Structural Information

Molecular Formula
C13H11NO3
SMILES
C1=CC=C(C=C1)C(=O)NC2=CC(=CC(=C2)O)O
InChI
InChI=1S/C13H11NO3/c15-11-6-10(7-12(16)8-11)14-13(17)9-4-2-1-3-5-9/h1-8,15-16H,(H,14,17)
InChIKey
DKYHVEQQTGMTQJ-UHFFFAOYSA-N
Compound name
N-(3,5-dihydroxyphenyl)benzamide
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

40
Patents

229.0739 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 230.081176 148.5
[M+Na]+ 252.063118 155.6
[M-H]- 228.066624 153.1
[M+NH4]+ 247.107723 164.7
[M+K]+ 268.037058 151.8
[M+H-H2O]+ 212.071160 141.6
[M+HCOO]- 274.072101 171.1
[M+CH3COO]- 288.087751 186.9
[M+Na-2H]- 250.048566 154.0
[M]+ 229.07335142 146.5
[M]- 229.07444858 146.5
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