CID 66934567

3-cyclooctene-1-methanol, alpha-ethyl-

Structural Information

Molecular Formula
C11H20O
SMILES
CCC(C1CCCC/C=C\C1)O
InChI
InChI=1S/C11H20O/c1-2-11(12)10-8-6-4-3-5-7-9-10/h4,6,10-12H,2-3,5,7-9H2,1H3/b6-4-
InChIKey
LLYJRIQMURUPPF-XQRVVYSFSA-N
Compound name
1-[(3Z)-cyclooct-3-en-1-yl]propan-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

81
Patents

168.15141 Da
Monoisotopic Mass

3.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 169.15869 141.2
[M+Na]+ 191.14063 144.6
[M+NH4]+ 186.18523 144.2
[M+K]+ 207.11457 144.1
[M-H]- 167.14413 141.9
[M+Na-2H]- 189.12608 144.5
[M]+ 168.15086 141.8
[M]- 168.15196 141.8
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

patents stripe