CID 135848704

N-[(z)-[(4-nitrophenyl)hydrazinylidene]methyl]-2-(2-oxopyrrolidin-1-yl)acetamide

Structural Information

Molecular Formula
C13H15N5O4
SMILES
C1CC(=O)N(C1)CC(=O)N/C=N\NC2=CC=C(C=C2)[N+](=O)[O-]
InChI
InChI=1S/C13H15N5O4/c19-12(8-17-7-1-2-13(17)20)14-9-15-16-10-3-5-11(6-4-10)18(21)22/h3-6,9,16H,1-2,7-8H2,(H,14,15,19)
InChIKey
GJZLRKZFRSQVNY-UHFFFAOYSA-N
Compound name
N-[(Z)-[(4-nitrophenyl)hydrazinylidene]methyl]-2-(2-oxopyrrolidin-1-yl)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

305.1124 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 306.11968 164.0
[M+Na]+ 328.10162 166.8
[M-H]- 304.10512 170.3
[M+NH4]+ 323.14622 177.3
[M+K]+ 344.07556 160.7
[M+H-H2O]+ 288.10966 159.2
[M+HCOO]- 350.11060 190.7
[M+CH3COO]- 364.12625 204.1
[M+Na-2H]- 326.08707 169.9
[M]+ 305.11185 159.9
[M]- 305.11295 159.9
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.