CID 89719

Methyl 2-(2-hydroxyphenyl)acetate

Structural Information

Molecular Formula
C9H10O3
SMILES
COC(=O)CC1=CC=CC=C1O
InChI
InChI=1S/C9H10O3/c1-12-9(11)6-7-4-2-3-5-8(7)10/h2-5,10H,6H2,1H3
InChIKey
BVBSGGBDFJUSIH-UHFFFAOYSA-N
Compound name
methyl 2-(2-hydroxyphenyl)acetate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

735
Patents

166.06299 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 167.07027 133.4
[M+Na]+ 189.05221 145.5
[M+NH4]+ 184.09681 141.2
[M+K]+ 205.02615 140.2
[M-H]- 165.05571 134.4
[M+Na-2H]- 187.03766 139.5
[M]+ 166.06244 135.2
[M]- 166.06354 135.2
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