CID 179519

Dtxsid90961838

Structural Information

Molecular Formula
C15H24O
SMILES
CC(C)C1CCC2(C3C1C2C(=CC3)CO)C
InChI
InChI=1S/C15H24O/c1-9(2)11-6-7-15(3)12-5-4-10(8-16)14(15)13(11)12/h4,9,11-14,16H,5-8H2,1-3H3
InChIKey
JIXPRNKLOIEGFI-UHFFFAOYSA-N
Compound name
(1-methyl-8-propan-2-yl-3-tricyclo[4.4.0.02,7]dec-3-enyl)methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

220.18271 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 221.189986 163.6
[M+Na]+ 243.171928 167.4
[M-H]- 219.175434 163.2
[M+NH4]+ 238.216533 181.5
[M+K]+ 259.145868 167.0
[M+H-H2O]+ 203.179970 154.1
[M+HCOO]- 265.180911 172.4
[M+CH3COO]- 279.196561 199.5
[M+Na-2H]- 241.157376 168.5
[M]+ 220.18216142 172.7
[M]- 220.18325858 172.7
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe