CID 9651797

N'-[(e)-(3,5-ditert-butyl-4-methylphenyl)methylidene]-2-(2-methyl-1h-benzimidazol-1-yl)acetohydrazide

Structural Information

Molecular Formula
C26H34N4O
SMILES
CC1=C(C=C(C=C1C(C)(C)C)/C=N/NC(=O)CN2C(=NC3=CC=CC=C32)C)C(C)(C)C
InChI
InChI=1S/C26H34N4O/c1-17-20(25(3,4)5)13-19(14-21(17)26(6,7)8)15-27-29-24(31)16-30-18(2)28-22-11-9-10-12-23(22)30/h9-15H,16H2,1-8H3,(H,29,31)/b27-15+
InChIKey
RGDJLECLLHAYJM-JFLMPSFJSA-N
Compound name
N-[(E)-(3,5-ditert-butyl-4-methylphenyl)methylideneamino]-2-(2-methylbenzimidazol-1-yl)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

418.27325 Da
Monoisotopic Mass

6.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 419.28053 211.0
[M+Na]+ 441.26247 218.9
[M-H]- 417.26597 218.2
[M+NH4]+ 436.30707 222.6
[M+K]+ 457.23641 213.4
[M+H-H2O]+ 401.27051 201.8
[M+HCOO]- 463.27145 230.3
[M+CH3COO]- 477.28710 238.0
[M+Na-2H]- 439.24792 212.9
[M]+ 418.27270 216.6
[M]- 418.27380 216.6
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.