CID 95446

Ethanone, 1-[4-(dimethylamino)phenyl]-2-hydroxy-2-phenyl-

Structural Information

Molecular Formula
C16H17NO2
SMILES
CN(C)C1=CC=C(C=C1)C(=O)C(C2=CC=CC=C2)O
InChI
InChI=1S/C16H17NO2/c1-17(2)14-10-8-13(9-11-14)16(19)15(18)12-6-4-3-5-7-12/h3-11,15,18H,1-2H3
InChIKey
SOLBSNQBVLAREX-UHFFFAOYSA-N
Compound name
1-[4-(dimethylamino)phenyl]-2-hydroxy-2-phenylethanone
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

7
References

778
Patents

255.12593 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 256.13321 158.9
[M+Na]+ 278.11515 164.0
[M-H]- 254.11865 165.4
[M+NH4]+ 273.15975 175.0
[M+K]+ 294.08909 161.7
[M+H-H2O]+ 238.12319 151.1
[M+HCOO]- 300.12413 181.3
[M+CH3COO]- 314.13978 199.9
[M+Na-2H]- 276.10060 161.9
[M]+ 255.12538 158.7
[M]- 255.12648 158.7
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