CID 71758518

2-(oxolan-3-yl)-1-phenylethan-1-ol

Structural Information

Molecular Formula
C12H16O2
SMILES
C1COCC1CC(C2=CC=CC=C2)O
InChI
InChI=1S/C12H16O2/c13-12(8-10-6-7-14-9-10)11-4-2-1-3-5-11/h1-5,10,12-13H,6-9H2
InChIKey
CWZRFQTVUOQGJV-UHFFFAOYSA-N
Compound name
2-(oxolan-3-yl)-1-phenylethanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

192.11504 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 193.12232 143.2
[M+Na]+ 215.10426 147.9
[M-H]- 191.10776 148.5
[M+NH4]+ 210.14886 162.0
[M+K]+ 231.07820 146.7
[M+H-H2O]+ 175.11230 137.1
[M+HCOO]- 237.11324 163.2
[M+CH3COO]- 251.12889 178.9
[M+Na-2H]- 213.08971 147.1
[M]+ 192.11449 140.5
[M]- 192.11559 140.5
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.