CID 527822

Isopiperitenol

Structural Information

Molecular Formula
C10H16O
SMILES
CC1=CC(C(CC1)C(=C)C)O
InChI
InChI=1S/C10H16O/c1-7(2)9-5-4-8(3)6-10(9)11/h6,9-11H,1,4-5H2,2-3H3
InChIKey
OLAKPNFIICOONC-UHFFFAOYSA-N
Compound name
3-methyl-6-prop-1-en-2-ylcyclohex-2-en-1-ol
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

12
References

191
Patents

152.12012 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 153.12740 134.3
[M+Na]+ 175.10934 145.7
[M+NH4]+ 170.15394 143.0
[M+K]+ 191.08328 139.7
[M-H]- 151.11284 136.0
[M+Na-2H]- 173.09479 139.1
[M]+ 152.11957 136.3
[M]- 152.12067 136.3
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