CID 522801

2-hydroxy-4-methoxy-3-methylbenzophenone

Structural Information

Molecular Formula
C15H14O3
SMILES
CC1=C(C=CC(=C1O)C(=O)C2=CC=CC=C2)OC
InChI
InChI=1S/C15H14O3/c1-10-13(18-2)9-8-12(14(10)16)15(17)11-6-4-3-5-7-11/h3-9,16H,1-2H3
InChIKey
CUWRRXIHOSRXGN-UHFFFAOYSA-N
Compound name
(2-hydroxy-4-methoxy-3-methylphenyl)-phenylmethanone
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

28
Patents

242.0943 Da
Monoisotopic Mass

3.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 243.101576 152.5
[M+Na]+ 265.083518 160.9
[M-H]- 241.087024 158.6
[M+NH4]+ 260.128123 169.5
[M+K]+ 281.057458 157.7
[M+H-H2O]+ 225.091560 145.6
[M+HCOO]- 287.092501 174.9
[M+CH3COO]- 301.108151 192.1
[M+Na-2H]- 263.068966 156.3
[M]+ 242.09375142 154.3
[M]- 242.09484858 154.3
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