CID 103549

51822-63-0

Structural Information

Molecular Formula
C12H13N3O4
SMILES
C1CC(=O)NC1C(=O)NNC(=O)C2=CC=CC=C2O
InChI
InChI=1S/C12H13N3O4/c16-9-4-2-1-3-7(9)11(18)14-15-12(19)8-5-6-10(17)13-8/h1-4,8,16H,5-6H2,(H,13,17)(H,14,18)(H,15,19)
InChIKey
GSJXNPYYEXPWOH-UHFFFAOYSA-N
Compound name
N'-(2-hydroxybenzoyl)-5-oxopyrrolidine-2-carbohydrazide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

263.0906 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 264.097876 156.9
[M+Na]+ 286.079818 161.4
[M-H]- 262.083324 159.6
[M+NH4]+ 281.124423 171.4
[M+K]+ 302.053758 158.4
[M+H-H2O]+ 246.087860 149.3
[M+HCOO]- 308.088801 177.0
[M+CH3COO]- 322.104451 192.8
[M+Na-2H]- 284.065266 158.1
[M]+ 263.09005142 151.4
[M]- 263.09114858 151.4
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.