CID 56842318

84522-28-1

Structural Information

Molecular Formula
C15H26O
SMILES
CC1CC2C(CC1CC2C(C=C)O)C(C)C
InChI
InChI=1S/C15H26O/c1-5-15(16)14-8-11-7-12(9(2)3)13(14)6-10(11)4/h5,9-16H,1,6-8H2,2-4H3
InChIKey
CPXNYDJEIBAYLC-UHFFFAOYSA-N
Compound name
1-(5-methyl-7-propan-2-yl-2-bicyclo[2.2.2]octanyl)prop-2-en-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

222.19836 Da
Monoisotopic Mass

4.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 223.205636 159.1
[M+Na]+ 245.187578 161.5
[M-H]- 221.191084 153.9
[M+NH4]+ 240.232183 181.4
[M+K]+ 261.161518 158.3
[M+H-H2O]+ 205.195620 155.2
[M+HCOO]- 267.196561 165.6
[M+CH3COO]- 281.212211 198.2
[M+Na-2H]- 243.173026 162.7
[M]+ 222.19781142 158.3
[M]- 222.19890858 158.3
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.