CID 347181

Methyl 2-benzamidobenzoate

Structural Information

Molecular Formula
C15H13NO3
SMILES
COC(=O)C1=CC=CC=C1NC(=O)C2=CC=CC=C2
InChI
InChI=1S/C15H13NO3/c1-19-15(18)12-9-5-6-10-13(12)16-14(17)11-7-3-2-4-8-11/h2-10H,1H3,(H,16,17)
InChIKey
NOMUELNZAGGIDL-UHFFFAOYSA-N
Compound name
methyl 2-benzamidobenzoate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

12
Patents

255.08954 Da
Monoisotopic Mass

3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 256.09682 157.6
[M+Na]+ 278.07876 170.5
[M+NH4]+ 273.12336 165.1
[M+K]+ 294.05270 164.1
[M-H]- 254.08226 161.6
[M+Na-2H]- 276.06421 166.3
[M]+ 255.08899 160.4
[M]- 255.09009 160.4
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