CID 72771

5680-83-1

Structural Information

Molecular Formula
C10H13N3O3
SMILES
C1=CC=C(C=C1)COC(=O)NCC(=O)NN
InChI
InChI=1S/C10H13N3O3/c11-13-9(14)6-12-10(15)16-7-8-4-2-1-3-5-8/h1-5H,6-7,11H2,(H,12,15)(H,13,14)
InChIKey
FBXJOIKPPWLCJU-UHFFFAOYSA-N
Compound name
benzyl N-(2-hydrazinyl-2-oxoethyl)carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

50
Patents

223.09569 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 224.102966 148.0
[M+Na]+ 246.084908 152.4
[M-H]- 222.088414 150.8
[M+NH4]+ 241.129513 164.6
[M+K]+ 262.058848 151.3
[M+H-H2O]+ 206.092950 140.4
[M+HCOO]- 268.093891 173.7
[M+CH3COO]- 282.109541 193.0
[M+Na-2H]- 244.070356 153.0
[M]+ 223.09514142 146.3
[M]- 223.09623858 146.3
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.