CID 45169

2-(beta-hydroxyethoxy)-n-methyl-5-phenylbenzamide

Structural Information

Molecular Formula
C16H17NO3
SMILES
CNC(=O)C1=C(C=CC(=C1)C2=CC=CC=C2)OCCO
InChI
InChI=1S/C16H17NO3/c1-17-16(19)14-11-13(12-5-3-2-4-6-12)7-8-15(14)20-10-9-18/h2-8,11,18H,9-10H2,1H3,(H,17,19)
InChIKey
MMWJCCRTDOVKIH-UHFFFAOYSA-N
Compound name
2-(2-hydroxyethoxy)-N-methyl-5-phenylbenzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

271.12085 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 272.12813 162.0
[M+Na]+ 294.11007 168.2
[M-H]- 270.11357 167.4
[M+NH4]+ 289.15467 177.2
[M+K]+ 310.08401 164.6
[M+H-H2O]+ 254.11811 154.2
[M+HCOO]- 316.11905 185.1
[M+CH3COO]- 330.13470 198.3
[M+Na-2H]- 292.09552 166.3
[M]+ 271.12030 162.9
[M]- 271.12140 162.9
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

No patent data available for this compound.