CID 3075276

Pentanoic acid, 2-((2,3-dimethylphenyl)amino)-2-propyl-, 2-phenylhydrazide

Structural Information

Molecular Formula
C22H31N3O
SMILES
CCCC(CCC)(C(=O)NNC1=CC=CC=C1)NC2=CC=CC(=C2C)C
InChI
InChI=1S/C22H31N3O/c1-5-15-22(16-6-2,23-20-14-10-11-17(3)18(20)4)21(26)25-24-19-12-8-7-9-13-19/h7-14,23-24H,5-6,15-16H2,1-4H3,(H,25,26)
InChIKey
QBHYDRJFOMVROZ-UHFFFAOYSA-N
Compound name
2-(2,3-dimethylanilino)-N'-phenyl-2-propylpentanehydrazide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

353.2467 Da
Monoisotopic Mass

6.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 354.25398 192.0
[M+Na]+ 376.23592 202.0
[M+NH4]+ 371.28052 198.5
[M+K]+ 392.20986 194.4
[M-H]- 352.23942 197.0
[M+Na-2H]- 374.22137 199.0
[M]+ 353.24615 194.7
[M]- 353.24725 194.7
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.