CID 3047077

Pinic acid, di-n-cyclohexylhydrazide

Structural Information

Molecular Formula
C21H38N4O2
SMILES
CC1(C(CC1C(=O)NNC2CCCCC2)CC(=O)NNC3CCCCC3)C
InChI
InChI=1S/C21H38N4O2/c1-21(2)15(14-19(26)24-22-16-9-5-3-6-10-16)13-18(21)20(27)25-23-17-11-7-4-8-12-17/h15-18,22-23H,3-14H2,1-2H3,(H,24,26)(H,25,27)
InChIKey
VGCVKHSKASZOAJ-UHFFFAOYSA-N
Compound name
N'-cyclohexyl-3-[2-(2-cyclohexylhydrazinyl)-2-oxoethyl]-2,2-dimethylcyclobutane-1-carbohydrazide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

378.29947 Da
Monoisotopic Mass

3.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 379.30675 196.4
[M+Na]+ 401.28869 190.8
[M-H]- 377.29219 201.9
[M+NH4]+ 396.33329 201.0
[M+K]+ 417.26263 192.2
[M+H-H2O]+ 361.29673 181.0
[M+HCOO]- 423.29767 210.1
[M+CH3COO]- 437.31332 230.9
[M+Na-2H]- 399.27414 193.1
[M]+ 378.29892 193.3
[M]- 378.30002 193.3
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.