CID 3075272

Hexanoic acid, 2-butyl-2-(diethylamino)-, 2-(4-chlorophenyl)hydrazide

Structural Information

Molecular Formula
C20H34ClN3O
SMILES
CCCCC(CCCC)(C(=O)NNC1=CC=C(C=C1)Cl)N(CC)CC
InChI
InChI=1S/C20H34ClN3O/c1-5-9-15-20(16-10-6-2,24(7-3)8-4)19(25)23-22-18-13-11-17(21)12-14-18/h11-14,22H,5-10,15-16H2,1-4H3,(H,23,25)
InChIKey
MRNBQRXJPATBKX-UHFFFAOYSA-N
Compound name
2-butyl-N'-(4-chlorophenyl)-2-(diethylamino)hexanehydrazide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

367.23904 Da
Monoisotopic Mass

6.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 368.24632 196.1
[M+Na]+ 390.22826 198.5
[M-H]- 366.23176 199.4
[M+NH4]+ 385.27286 209.2
[M+K]+ 406.20220 194.1
[M+H-H2O]+ 350.23630 188.4
[M+HCOO]- 412.23724 213.8
[M+CH3COO]- 426.25289 229.1
[M+Na-2H]- 388.21371 196.7
[M]+ 367.23849 201.0
[M]- 367.23959 201.0
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.