CID 69050

Ethyl diphenylcarbamate

Structural Information

Molecular Formula
C15H15NO2
SMILES
CCOC(=O)N(C1=CC=CC=C1)C2=CC=CC=C2
InChI
InChI=1S/C15H15NO2/c1-2-18-15(17)16(13-9-5-3-6-10-13)14-11-7-4-8-12-14/h3-12H,2H2,1H3
InChIKey
HKTSLDUAGCAISP-UHFFFAOYSA-N
Compound name
ethyl N,N-diphenylcarbamate
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

4
References

304
Patents

241.11028 Da
Monoisotopic Mass

3.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 242.11756 154.9
[M+Na]+ 264.09950 160.3
[M-H]- 240.10300 162.6
[M+NH4]+ 259.14410 172.1
[M+K]+ 280.07344 158.5
[M+H-H2O]+ 224.10754 146.6
[M+HCOO]- 286.10848 180.1
[M+CH3COO]- 300.12413 196.1
[M+Na-2H]- 262.08495 160.7
[M]+ 241.10973 156.1
[M]- 241.11083 156.1
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