CID 14785278

Rac-(3r,4s)-4-phenyloxolan-3-ol

Structural Information

Molecular Formula
C10H12O2
SMILES
C1[C@H]([C@@H](CO1)O)C2=CC=CC=C2
InChI
InChI=1S/C10H12O2/c11-10-7-12-6-9(10)8-4-2-1-3-5-8/h1-5,9-11H,6-7H2/t9-,10+/m0/s1
InChIKey
DMERZAYEXRFPAW-VHSXEESVSA-N
Compound name
(3S,4R)-4-phenyloxolan-3-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

28
Patents

164.08372 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 165.09100 132.8
[M+Na]+ 187.07294 139.6
[M-H]- 163.07644 138.8
[M+NH4]+ 182.11754 153.1
[M+K]+ 203.04688 138.4
[M+H-H2O]+ 147.08098 127.3
[M+HCOO]- 209.08192 154.5
[M+CH3COO]- 223.09757 173.1
[M+Na-2H]- 185.05839 138.4
[M]+ 164.08317 130.4
[M]- 164.08427 130.4
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.