CID 21798

Anilamate

Structural Information

Molecular Formula
C15H14N2O3
SMILES
CNC(=O)OC1=CC=CC=C1C(=O)NC2=CC=CC=C2
InChI
InChI=1S/C15H14N2O3/c1-16-15(19)20-13-10-6-5-9-12(13)14(18)17-11-7-3-2-4-8-11/h2-10H,1H3,(H,16,19)(H,17,18)
InChIKey
BEECRKDUIIQEBI-UHFFFAOYSA-N
Compound name
[2-(phenylcarbamoyl)phenyl] N-methylcarbamate
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

4
References

44
Patents

270.10043 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 271.107706 160.6
[M+Na]+ 293.089648 165.9
[M-H]- 269.093154 167.3
[M+NH4]+ 288.134253 175.8
[M+K]+ 309.063588 163.4
[M+H-H2O]+ 253.097690 152.2
[M+HCOO]- 315.098631 185.8
[M+CH3COO]- 329.114281 200.5
[M+Na-2H]- 291.075096 165.8
[M]+ 270.09988142 160.3
[M]- 270.10097858 160.3
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