CID 3024245

Mouswgfjeqdfjb-uhfffaoysa-n

Structural Information

Molecular Formula
C14H24O
SMILES
CC(C)C1CCC(=CC1)C=CCCCO
InChI
InChI=1S/C14H24O/c1-12(2)14-9-7-13(8-10-14)6-4-3-5-11-15/h4,6-7,12,14-15H,3,5,8-11H2,1-2H3
InChIKey
MOUSWGFJEQDFJB-UHFFFAOYSA-N
Compound name
5-(4-propan-2-ylcyclohexen-1-yl)pent-4-en-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

208.18271 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 209.189986 153.1
[M+Na]+ 231.171928 156.9
[M-H]- 207.175434 154.1
[M+NH4]+ 226.216533 171.4
[M+K]+ 247.145868 153.7
[M+H-H2O]+ 191.179970 147.3
[M+HCOO]- 253.180911 171.0
[M+CH3COO]- 267.196561 187.0
[M+Na-2H]- 229.157376 154.2
[M]+ 208.18216142 150.4
[M]- 208.18325858 150.4
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.