CID 2331

Benzamide

Structural Information

Molecular Formula
C7H7NO
SMILES
C1=CC=C(C=C1)C(=O)N
InChI
InChI=1S/C7H7NO/c8-7(9)6-4-2-1-3-5-6/h1-5H,(H2,8,9)
InChIKey
KXDAEFPNCMNJSK-UHFFFAOYSA-N
Compound name
benzamide
Related CIDs

2D Structure

compound 2d structure
6
Annotation Hits

5348
References

111907
Patents

121.052765 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 122.06004 122.3
[M+Na]+ 144.04198 134.4
[M+NH4]+ 139.08659 131.3
[M+K]+ 160.01592 128.6
[M-H]- 120.04549 125.0
[M+Na-2H]- 142.02743 130.0
[M]+ 121.05222 124.6
[M]- 121.05331 124.6
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