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]+ 207.08765 141.7
[M+Na]+ 229.06959 148.1
[M-H]- 205.07309 145.4
[M+NH4]+ 224.11419 158.5
[M+K]+ 245.04353 141.9
[M+H-H2O]+ 189.07763 138.5
[M+HCOO]- 251.07857 170.0
[M+CH3COO]- 265.09422 185.4
[M+Na-2H]- 227.05504 151.5
[M]+ 206.07982 140.0
[M]- 206.08092 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.