CID 557325

4a(2h)-naphthalenemethanol, octahydro-

Structural Information

Molecular Formula
C11H20O
SMILES
C1CCC2(CCCCC2C1)CO
InChI
InChI=1S/C11H20O/c12-9-11-7-3-1-5-10(11)6-2-4-8-11/h10,12H,1-9H2
InChIKey
ZVYRRWLYOCFIMM-UHFFFAOYSA-N
Compound name
2,3,4,5,6,7,8,8a-octahydro-1H-naphthalen-4a-ylmethanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

13
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 140.4
[M+Na]+ 191.14063 143.7
[M-H]- 167.14413 142.0
[M+NH4]+ 186.18523 162.7
[M+K]+ 207.11457 141.3
[M+H-H2O]+ 151.14867 135.1
[M+HCOO]- 213.14961 155.6
[M+CH3COO]- 227.16526 175.6
[M+Na-2H]- 189.12608 146.1
[M]+ 168.15086 132.4
[M]- 168.15196 132.4
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.