CID 3018508

74441-06-8

Structural Information

Molecular Formula
C14H13N3O2
SMILES
C1=CC(=CC=C1C(=O)NC2=CC=C(C=C2)C(=O)N)N
InChI
InChI=1S/C14H13N3O2/c15-11-5-1-10(2-6-11)14(19)17-12-7-3-9(4-8-12)13(16)18/h1-8H,15H2,(H2,16,18)(H,17,19)
InChIKey
FSPYMSUDIVFOHY-UHFFFAOYSA-N
Compound name
4-amino-N-(4-carbamoylphenyl)benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

77
Patents

255.10077 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 256.10805 157.2
[M+Na]+ 278.08999 163.1
[M-H]- 254.09349 163.3
[M+NH4]+ 273.13459 172.3
[M+K]+ 294.06393 159.6
[M+H-H2O]+ 238.09803 149.1
[M+HCOO]- 300.09897 182.2
[M+CH3COO]- 314.11462 202.1
[M+Na-2H]- 276.07544 160.5
[M]+ 255.10022 153.1
[M]- 255.10132 153.1
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.