CID 10104081

2-[2-(oxiran-2-ylmethoxy)phenyl]ethanol

Structural Information

Molecular Formula
C11H14O3
SMILES
C1C(O1)COC2=CC=CC=C2CCO
InChI
InChI=1S/C11H14O3/c12-6-5-9-3-1-2-4-11(9)14-8-10-7-13-10/h1-4,10,12H,5-8H2
InChIKey
QNDZOBZHSUMVSM-UHFFFAOYSA-N
Compound name
2-[2-(oxiran-2-ylmethoxy)phenyl]ethanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

194.0943 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 195.101576 139.5
[M+Na]+ 217.083518 148.5
[M-H]- 193.087024 146.5
[M+NH4]+ 212.128123 152.4
[M+K]+ 233.057458 147.0
[M+H-H2O]+ 177.091560 132.7
[M+HCOO]- 239.092501 162.1
[M+CH3COO]- 253.108151 183.7
[M+Na-2H]- 215.068966 147.0
[M]+ 194.09375142 144.8
[M]- 194.09484858 144.8
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