CID 5355690

Crotonaldehyde, (5-nitro-2-pyridyl)hydrazone

Structural Information

Molecular Formula
C9H10N4O2
SMILES
C/C=C/C=N/NC1=NC=C(C=C1)[N+](=O)[O-]
InChI
InChI=1S/C9H10N4O2/c1-2-3-6-11-12-9-5-4-8(7-10-9)13(14)15/h2-7H,1H3,(H,10,12)/b3-2+,11-6+
InChIKey
DISZNMXDCFJPQT-PDGXAJGZSA-N
Compound name
N-[(E)-[(E)-but-2-enylidene]amino]-5-nitropyridin-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

206.08037 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 207.087646 141.7
[M+Na]+ 229.069588 148.1
[M-H]- 205.073094 145.4
[M+NH4]+ 224.114193 158.5
[M+K]+ 245.043528 141.9
[M+H-H2O]+ 189.077630 138.5
[M+HCOO]- 251.078571 170.0
[M+CH3COO]- 265.094221 185.4
[M+Na-2H]- 227.055036 151.5
[M]+ 206.07982142 140.0
[M]- 206.08091858 140.0
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.