CID 51060869

N'-(2-methyl-3-phenyl-2-propenylidene)-2-(4-nitrophenoxy)propanohydrazide

Structural Information

Molecular Formula
C19H19N3O4
SMILES
CC(C(=O)N/N=C/C(=C\C1=CC=CC=C1)/C)OC2=CC=C(C=C2)[N+](=O)[O-]
InChI
InChI=1S/C19H19N3O4/c1-14(12-16-6-4-3-5-7-16)13-20-21-19(23)15(2)26-18-10-8-17(9-11-18)22(24)25/h3-13,15H,1-2H3,(H,21,23)/b14-12-,20-13+
InChIKey
VQGLJFCBUIIDNT-RUKGVYQZSA-N
Compound name
N-[(E)-[(Z)-2-methyl-3-phenylprop-2-enylidene]amino]-2-(4-nitrophenoxy)propanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

353.13754 Da
Monoisotopic Mass

3.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 354.144816 183.3
[M+Na]+ 376.126758 185.4
[M-H]- 352.130264 190.3
[M+NH4]+ 371.171363 194.3
[M+K]+ 392.100698 178.6
[M+H-H2O]+ 336.134800 178.2
[M+HCOO]- 398.135741 208.3
[M+CH3COO]- 412.151391 213.5
[M+Na-2H]- 374.112206 186.9
[M]+ 353.13699142 182.0
[M]- 353.13808858 182.0
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.