CID 63080436

1-(1-phenylcyclopentyl)ethan-1-ol

Structural Information

Molecular Formula
C13H18O
SMILES
CC(C1(CCCC1)C2=CC=CC=C2)O
InChI
InChI=1S/C13H18O/c1-11(14)13(9-5-6-10-13)12-7-3-2-4-8-12/h2-4,7-8,11,14H,5-6,9-10H2,1H3
InChIKey
OLDXGGGHOCSMIT-UHFFFAOYSA-N
Compound name
1-(1-phenylcyclopentyl)ethanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

190.13577 Da
Monoisotopic Mass

3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 191.143046 145.3
[M+Na]+ 213.124988 150.5
[M-H]- 189.128494 150.2
[M+NH4]+ 208.169593 167.5
[M+K]+ 229.098928 147.7
[M+H-H2O]+ 173.133030 139.6
[M+HCOO]- 235.133971 165.7
[M+CH3COO]- 249.149621 179.5
[M+Na-2H]- 211.110436 148.7
[M]+ 190.13522142 141.1
[M]- 190.13631858 141.1
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.