CID 9665476

N-(2-(2-(4-(dimethylamino)benzylidene)hydrazino)-2-oxoethyl)-4-propoxybenzamide

Structural Information

Molecular Formula
C21H26N4O3
SMILES
CCCOC1=CC=C(C=C1)C(=O)NCC(=O)N/N=C/C2=CC=C(C=C2)N(C)C
InChI
InChI=1S/C21H26N4O3/c1-4-13-28-19-11-7-17(8-12-19)21(27)22-15-20(26)24-23-14-16-5-9-18(10-6-16)25(2)3/h5-12,14H,4,13,15H2,1-3H3,(H,22,27)(H,24,26)/b23-14+
InChIKey
SNJDLTNODMFSMW-OEAKJJBVSA-N
Compound name
N-[2-[(2E)-2-[[4-(dimethylamino)phenyl]methylidene]hydrazinyl]-2-oxoethyl]-4-propoxybenzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

382.2005 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 383.20778 194.0
[M+Na]+ 405.18972 196.5
[M-H]- 381.19322 202.5
[M+NH4]+ 400.23432 205.2
[M+K]+ 421.16366 194.7
[M+H-H2O]+ 365.19776 183.3
[M+HCOO]- 427.19870 221.1
[M+CH3COO]- 441.21435 234.9
[M+Na-2H]- 403.17517 195.9
[M]+ 382.19995 197.1
[M]- 382.20105 197.1
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.