CID 84656521

[3-(oxolan-3-yl)phenyl]methanol

Structural Information

Molecular Formula
C11H14O2
SMILES
C1COCC1C2=CC=CC(=C2)CO
InChI
InChI=1S/C11H14O2/c12-7-9-2-1-3-10(6-9)11-4-5-13-8-11/h1-3,6,11-12H,4-5,7-8H2
InChIKey
MDRNIJCAIVQCLA-UHFFFAOYSA-N
Compound name
[3-(oxolan-3-yl)phenyl]methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

4
Patents

178.09938 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 179.10666 137.5
[M+Na]+ 201.08860 143.9
[M-H]- 177.09210 143.3
[M+NH4]+ 196.13320 157.3
[M+K]+ 217.06254 142.4
[M+H-H2O]+ 161.09664 131.8
[M+HCOO]- 223.09758 158.9
[M+CH3COO]- 237.11323 176.1
[M+Na-2H]- 199.07405 142.5
[M]+ 178.09883 135.5
[M]- 178.09993 135.5
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

patents stripe