CID 83611

2-(3-methylphenoxy)ethanol

Structural Information

Molecular Formula
C9H12O2
SMILES
CC1=CC(=CC=C1)OCCO
InChI
InChI=1S/C9H12O2/c1-8-3-2-4-9(7-8)11-6-5-10/h2-4,7,10H,5-6H2,1H3
InChIKey
FDBXUXVQIOQYIX-UHFFFAOYSA-N
Compound name
2-(3-methylphenoxy)ethanol
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

308
Patents

152.08372 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 153.09100 130.6
[M+Na]+ 175.07294 143.5
[M+NH4]+ 170.11754 139.4
[M+K]+ 191.04688 137.0
[M-H]- 151.07644 132.6
[M+Na-2H]- 173.05839 137.7
[M]+ 152.08317 133.0
[M]- 152.08427 133.0
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