CID 82200

2-(2-hydroxyethyl)phenol

Structural Information

Molecular Formula
C8H10O2
SMILES
C1=CC=C(C(=C1)CCO)O
InChI
InChI=1S/C8H10O2/c9-6-5-7-3-1-2-4-8(7)10/h1-4,9-10H,5-6H2
InChIKey
ABFCOJLLBHXNOU-UHFFFAOYSA-N
Compound name
2-(2-hydroxyethyl)phenol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

38
References

1788
Patents

138.06808 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 139.075356 126.4
[M+Na]+ 161.057298 134.3
[M-H]- 137.060804 127.7
[M+NH4]+ 156.101903 147.0
[M+K]+ 177.031238 131.9
[M+H-H2O]+ 121.065340 121.6
[M+HCOO]- 183.066281 148.8
[M+CH3COO]- 197.081931 168.2
[M+Na-2H]- 159.042746 133.5
[M]+ 138.06753142 125.5
[M]- 138.06862858 125.5
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe