CID 6876708

3-nitrobenzaldehyde dimethylhydrazone

Structural Information

Molecular Formula
C9H11N3O2
SMILES
CN(C)/N=C/C1=CC(=CC=C1)[N+](=O)[O-]
InChI
InChI=1S/C9H11N3O2/c1-11(2)10-7-8-4-3-5-9(6-8)12(13)14/h3-7H,1-2H3/b10-7+
InChIKey
DWRUVQSAQYOWIR-JXMROGBWSA-N
Compound name
N-methyl-N-[(E)-(3-nitrophenyl)methylideneamino]methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

193.08513 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 194.09241 139.8
[M+Na]+ 216.07435 151.9
[M+NH4]+ 211.11895 148.1
[M+K]+ 232.04829 148.4
[M-H]- 192.07785 144.7
[M+Na-2H]- 214.05980 147.1
[M]+ 193.08458 142.6
[M]- 193.08568 142.6
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.