CID 548725

Tricyclo[4.2.1.1(2,5)]dec-3-en-9-ol, stereoisomer

Structural Information

Molecular Formula
C10H14O
SMILES
C1CC2C3CC(C1C2O)C=C3
InChI
InChI=1S/C10H14O/c11-10-8-3-4-9(10)7-2-1-6(8)5-7/h1-2,6-11H,3-5H2
InChIKey
WORZCCQYOYQTEW-UHFFFAOYSA-N
Compound name
tricyclo[4.2.1.12,5]dec-3-en-9-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

150.10446 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 151.111736 132.5
[M+Na]+ 173.093678 140.1
[M-H]- 149.097184 133.7
[M+NH4]+ 168.138283 160.1
[M+K]+ 189.067618 136.8
[M+H-H2O]+ 133.101720 129.3
[M+HCOO]- 195.102661 150.4
[M+CH3COO]- 209.118311 145.8
[M+Na-2H]- 171.079126 137.2
[M]+ 150.10391142 130.3
[M]- 150.10500858 130.3
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.