CID 2775609

1-(2-hydroxy-4-methoxyphenyl)-2-phenylethanone

Structural Information

Molecular Formula
C15H14O3
SMILES
COC1=CC(=C(C=C1)C(=O)CC2=CC=CC=C2)O
InChI
InChI=1S/C15H14O3/c1-18-12-7-8-13(15(17)10-12)14(16)9-11-5-3-2-4-6-11/h2-8,10,17H,9H2,1H3
InChIKey
WYMYJTSWNPZKHM-UHFFFAOYSA-N
Compound name
1-(2-hydroxy-4-methoxyphenyl)-2-phenylethanone
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

27
Patents

242.0943 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 243.10158 153.1
[M+Na]+ 265.08352 160.6
[M-H]- 241.08702 158.8
[M+NH4]+ 260.12812 169.8
[M+K]+ 281.05746 157.2
[M+H-H2O]+ 225.09156 145.9
[M+HCOO]- 287.09250 175.5
[M+CH3COO]- 301.10815 190.9
[M+Na-2H]- 263.06897 157.6
[M]+ 242.09375 154.4
[M]- 242.09485 154.4
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