CID 84902

2-hydroxy-4-acryloyloxybenzophenone

Structural Information

Molecular Formula
C16H12O4
SMILES
C=CC(=O)OC1=CC(=C(C=C1)C(=O)C2=CC=CC=C2)O
InChI
InChI=1S/C16H12O4/c1-2-15(18)20-12-8-9-13(14(17)10-12)16(19)11-6-4-3-5-7-11/h2-10,17H,1H2
InChIKey
LJWQJECMFUGUDV-UHFFFAOYSA-N
Compound name
(4-benzoyl-3-hydroxyphenyl) prop-2-enoate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

706
Patents

268.07355 Da
Monoisotopic Mass

3.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 269.080826 158.4
[M+Na]+ 291.062768 165.6
[M-H]- 267.066274 164.0
[M+NH4]+ 286.107373 173.7
[M+K]+ 307.036708 162.0
[M+H-H2O]+ 251.070810 151.0
[M+HCOO]- 313.071751 180.0
[M+CH3COO]- 327.087401 194.7
[M+Na-2H]- 289.048216 161.2
[M]+ 268.07300142 159.4
[M]- 268.07409858 159.4
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