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]+ 193.122316 143.2
[M+Na]+ 215.104258 147.9
[M-H]- 191.107764 148.5
[M+NH4]+ 210.148863 162.0
[M+K]+ 231.078198 146.7
[M+H-H2O]+ 175.112300 137.1
[M+HCOO]- 237.113241 163.2
[M+CH3COO]- 251.128891 178.9
[M+Na-2H]- 213.089706 147.1
[M]+ 192.11449142 140.5
[M]- 192.11558858 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.