CID 76824

Carbonazidic acid, diphenylmethyl ester

Structural Information

Molecular Formula
C14H11N3O2
SMILES
C1=CC=C(C=C1)C(C2=CC=CC=C2)OC(=O)N=[N+]=[N-]
InChI
InChI=1S/C14H11N3O2/c15-17-16-14(18)19-13(11-7-3-1-4-8-11)12-9-5-2-6-10-12/h1-10,13H
InChIKey
HTNFWNXJCKRKTG-UHFFFAOYSA-N
Compound name
benzhydryl N-diazocarbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

9
Patents

253.08513 Da
Monoisotopic Mass

4.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 254.09241 155.8
[M+Na]+ 276.07435 169.6
[M+NH4]+ 271.11895 164.3
[M+K]+ 292.04829 164.0
[M-H]- 252.07785 163.2
[M+Na-2H]- 274.05980 166.3
[M]+ 253.08458 159.7
[M]- 253.08568 159.7
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

patents stripe