CID 9570403

P-nitrophenylglyoxal n,n-dimethylhydrazone

Structural Information

Molecular Formula
C10H11N3O3
SMILES
CN(C)/N=C/C(=O)C1=CC=C(C=C1)[N+](=O)[O-]
InChI
InChI=1S/C10H11N3O3/c1-12(2)11-7-10(14)8-3-5-9(6-4-8)13(15)16/h3-7H,1-2H3/b11-7+
InChIKey
XCXOXKAHWNKLJY-YRNVUSSQSA-N
Compound name
(2E)-2-(dimethylhydrazinylidene)-1-(4-nitrophenyl)ethanone
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

221.08005 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 222.08733 145.8
[M+Na]+ 244.06927 151.5
[M-H]- 220.07277 152.2
[M+NH4]+ 239.11387 163.7
[M+K]+ 260.04321 147.6
[M+H-H2O]+ 204.07731 143.0
[M+HCOO]- 266.07825 174.7
[M+CH3COO]- 280.09390 192.7
[M+Na-2H]- 242.05472 152.8
[M]+ 221.07950 146.0
[M]- 221.08060 146.0
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.