CID 9645159

N-(3-methylphenyl)-4-(2-(1-(4-methylphenyl)ethylidene)hydrazino)-4-oxobutanamide

Structural Information

Molecular Formula
C20H23N3O2
SMILES
CC1=CC=C(C=C1)/C(=N/NC(=O)CCC(=O)NC2=CC=CC(=C2)C)/C
InChI
InChI=1S/C20H23N3O2/c1-14-7-9-17(10-8-14)16(3)22-23-20(25)12-11-19(24)21-18-6-4-5-15(2)13-18/h4-10,13H,11-12H2,1-3H3,(H,21,24)(H,23,25)/b22-16+
InChIKey
WYULDXPDUKPZQV-CJLVFECKSA-N
Compound name
N-(3-methylphenyl)-N'-[(E)-1-(4-methylphenyl)ethylideneamino]butanediamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

337.17902 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 338.18630 183.5
[M+Na]+ 360.16824 187.1
[M-H]- 336.17174 190.9
[M+NH4]+ 355.21284 196.4
[M+K]+ 376.14218 183.8
[M+H-H2O]+ 320.17628 174.0
[M+HCOO]- 382.17722 208.3
[M+CH3COO]- 396.19287 222.2
[M+Na-2H]- 358.15369 184.8
[M]+ 337.17847 183.7
[M]- 337.17957 183.7
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.