CID 578384

4-methoxyphenyl 4-hydroxybenzoate

Structural Information

Molecular Formula
C14H12O4
SMILES
COC1=CC=C(C=C1)OC(=O)C2=CC=C(C=C2)O
InChI
InChI=1S/C14H12O4/c1-17-12-6-8-13(9-7-12)18-14(16)10-2-4-11(15)5-3-10/h2-9,15H,1H3
InChIKey
MTQSVJUCLQYISS-UHFFFAOYSA-N
Compound name
(4-methoxyphenyl) 4-hydroxybenzoate
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

78
Patents

244.07356 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 245.080836 151.8
[M+Na]+ 267.062778 159.6
[M-H]- 243.066284 157.7
[M+NH4]+ 262.107383 168.4
[M+K]+ 283.036718 157.2
[M+H-H2O]+ 227.070820 144.5
[M+HCOO]- 289.071761 174.7
[M+CH3COO]- 303.087411 189.4
[M+Na-2H]- 265.048226 156.8
[M]+ 244.07301142 154.1
[M]- 244.07410858 154.1
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