CID 5709439

(2e)-1-(2-chlorophenyl)-3-(4-hydroxyphenyl)prop-2-en-1-one

Structural Information

Molecular Formula
C15H11ClO2
SMILES
C1=CC=C(C(=C1)C(=O)/C=C/C2=CC=C(C=C2)O)Cl
InChI
InChI=1S/C15H11ClO2/c16-14-4-2-1-3-13(14)15(18)10-7-11-5-8-12(17)9-6-11/h1-10,17H/b10-7+
InChIKey
FDGQCKIOOCJPLO-JXMROGBWSA-N
Compound name
(E)-1-(2-chlorophenyl)-3-(4-hydroxyphenyl)prop-2-en-1-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

258.04477 Da
Monoisotopic Mass

4.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 259.05205 155.0
[M+Na]+ 281.03399 163.9
[M-H]- 257.03749 160.6
[M+NH4]+ 276.07859 172.1
[M+K]+ 297.00793 157.4
[M+H-H2O]+ 241.04203 149.0
[M+HCOO]- 303.04297 173.0
[M+CH3COO]- 317.05862 191.1
[M+Na-2H]- 279.01944 159.1
[M]+ 258.04422 156.4
[M]- 258.04532 156.4
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe