CID 81722

Delta-terpineol

Structural Information

Molecular Formula
C10H18O
SMILES
CC(C)(C1CCC(=C)CC1)O
InChI
InChI=1S/C10H18O/c1-8-4-6-9(7-5-8)10(2,3)11/h9,11H,1,4-7H2,2-3H3
InChIKey
SQIFACVGCPWBQZ-UHFFFAOYSA-N
Compound name
2-(4-methylidenecyclohexyl)propan-2-ol
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

0
References

60321
Patents

154.13577 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 155.14305 135.6
[M+Na]+ 177.12499 140.8
[M-H]- 153.12849 137.3
[M+NH4]+ 172.16959 156.2
[M+K]+ 193.09893 138.8
[M+H-H2O]+ 137.13303 131.2
[M+HCOO]- 199.13397 152.9
[M+CH3COO]- 213.14962 175.4
[M+Na-2H]- 175.11044 139.9
[M]+ 154.13522 130.4
[M]- 154.13632 130.4
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.