CID 225489

Methyl 4-(benzyloxy)-2-hydroxybenzoate

Structural Information

Molecular Formula

C₁₅H₁₄O₄

SMILES

COC(=O)C1=C(C=C(C=C1)OCC2=CC=CC=C2)O

InChI

InChI=1S/C15H14O4/c1-18-15(17)13-8-7-12(9-14(13)16)19-10-11-5-3-2-4-6-11/h2-9,16H,10H2,1H3

InChIKey

PHYPTZODBQEMJU-UHFFFAOYSA-N

Compound name

methyl 2-hydroxy-4-phenylmethoxybenzoate

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 222
Patents: 258.0892 Da
Monoisotopic Mass: 3.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	259.09648	157.4
[M+Na]+	281.07842	171.2
[M+NH4]+	276.12302	164.9
[M+K]+	297.05236	164.7
[M-H]-	257.08192	160.7
[M+Na-2H]-	279.06387	165.6
[M]+	258.08865	160.2
[M]-	258.08975	160.2

Literature stripe

literature stripe

Patent stripe

patents stripe