CID 9560413

N'-[4-(dimethylamino)benzylidene]-3-(4,5-diphenyl-1h-imidazol-1-yl)propanohydrazide

Structural Information

Molecular Formula
C27H27N5O
SMILES
CN(C)C1=CC=C(C=C1)/C=N/NC(=O)CCN2C=NC(=C2C3=CC=CC=C3)C4=CC=CC=C4
InChI
InChI=1S/C27H27N5O/c1-31(2)24-15-13-21(14-16-24)19-29-30-25(33)17-18-32-20-28-26(22-9-5-3-6-10-22)27(32)23-11-7-4-8-12-23/h3-16,19-20H,17-18H2,1-2H3,(H,30,33)/b29-19+
InChIKey
XSWUMBGTXUEPED-VUTHCHCSSA-N
Compound name
N-[(E)-[4-(dimethylamino)phenyl]methylideneamino]-3-(4,5-diphenylimidazol-1-yl)propanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

437.22156 Da
Monoisotopic Mass

4.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 438.22884 208.0
[M+Na]+ 460.21078 211.8
[M-H]- 436.21428 220.2
[M+NH4]+ 455.25538 215.6
[M+K]+ 476.18472 205.8
[M+H-H2O]+ 420.21882 194.5
[M+HCOO]- 482.21976 232.9
[M+CH3COO]- 496.23541 216.3
[M+Na-2H]- 458.19623 209.6
[M]+ 437.22101 209.3
[M]- 437.22211 209.3
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.