CID 9578708

Propionyl chloride 4-nitrophenylhydrazone

Structural Information

Molecular Formula
C9H10ClN3O2
SMILES
CC/C(=N/NC1=CC=C(C=C1)[N+](=O)[O-])/Cl
InChI
InChI=1S/C9H10ClN3O2/c1-2-9(10)12-11-7-3-5-8(6-4-7)13(14)15/h3-6,11H,2H2,1H3/b12-9-
InChIKey
WDJNYBDLUWPEFR-XFXZXTDPSA-N
Compound name
(1Z)-N-(4-nitrophenyl)propanehydrazonoyl chloride
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

227.04616 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 228.05344 145.6
[M+Na]+ 250.03538 158.0
[M+NH4]+ 245.07998 153.8
[M+K]+ 266.00932 153.9
[M-H]- 226.03888 150.0
[M+Na-2H]- 248.02083 152.5
[M]+ 227.04561 148.6
[M]- 227.04671 148.6
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.