CID 15587412

2-butyl-n-phenylnorleucine 2-(4-chlorophenyl)hydrazide

Structural Information

Molecular Formula
C22H30ClN3O
SMILES
CCCCC(CCCC)(C(=O)NNC1=CC=C(C=C1)Cl)NC2=CC=CC=C2
InChI
InChI=1S/C22H30ClN3O/c1-3-5-16-22(17-6-4-2,24-19-10-8-7-9-11-19)21(27)26-25-20-14-12-18(23)13-15-20/h7-15,24-25H,3-6,16-17H2,1-2H3,(H,26,27)
InChIKey
RHLQNZUGUBSFOA-UHFFFAOYSA-N
Compound name
2-anilino-2-butyl-N'-(4-chlorophenyl)hexanehydrazide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

387.20773 Da
Monoisotopic Mass

7.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 388.21501 197.0
[M+Na]+ 410.19695 199.6
[M-H]- 386.20045 202.0
[M+NH4]+ 405.24155 208.1
[M+K]+ 426.17089 193.0
[M+H-H2O]+ 370.20499 188.3
[M+HCOO]- 432.20593 215.0
[M+CH3COO]- 446.22158 227.4
[M+Na-2H]- 408.18240 200.3
[M]+ 387.20718 199.0
[M]- 387.20828 199.0
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.