CID 78644

Phenyl n-phenylcarbamate

Structural Information

Molecular Formula
C13H11NO2
SMILES
C1=CC=C(C=C1)NC(=O)OC2=CC=CC=C2
InChI
InChI=1S/C13H11NO2/c15-13(14-11-7-3-1-4-8-11)16-12-9-5-2-6-10-12/h1-10H,(H,14,15)
InChIKey
XVNKRRXASPPECQ-UHFFFAOYSA-N
Compound name
phenyl N-phenylcarbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

12
References

2898
Patents

213.07898 Da
Monoisotopic Mass

3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 214.08626 145.3
[M+Na]+ 236.06820 151.6
[M-H]- 212.07170 151.9
[M+NH4]+ 231.11280 163.1
[M+K]+ 252.04214 148.8
[M+H-H2O]+ 196.07624 137.7
[M+HCOO]- 258.07718 170.8
[M+CH3COO]- 272.09283 186.7
[M+Na-2H]- 234.05365 153.1
[M]+ 213.07843 144.7
[M]- 213.07953 144.7
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.