CID 206764

Propanamide, 2-(4-cyclohexyl-1-cyclohexen-1-yl)-n-ethyl-

Structural Information

Molecular Formula
C17H29NO
SMILES
CCNC(=O)C(C)C1=CCC(CC1)C2CCCCC2
InChI
InChI=1S/C17H29NO/c1-3-18-17(19)13(2)14-9-11-16(12-10-14)15-7-5-4-6-8-15/h9,13,15-16H,3-8,10-12H2,1-2H3,(H,18,19)
InChIKey
SXQKVUQFXDWGFG-UHFFFAOYSA-N
Compound name
2-(4-cyclohexylcyclohexen-1-yl)-N-ethylpropanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

263.2249 Da
Monoisotopic Mass

4.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 264.23218 167.5
[M+Na]+ 286.21412 167.5
[M-H]- 262.21762 171.8
[M+NH4]+ 281.25872 183.1
[M+K]+ 302.18806 164.8
[M+H-H2O]+ 246.22216 159.7
[M+HCOO]- 308.22310 183.0
[M+CH3COO]- 322.23875 201.1
[M+Na-2H]- 284.19957 166.1
[M]+ 263.22435 159.5
[M]- 263.22545 159.5
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.