CID 96552

Hydracrylamide, 2,3,3-triphenyl-

Structural Information

Molecular Formula
C21H19NO2
SMILES
C1=CC=C(C=C1)C(C(=O)N)C(C2=CC=CC=C2)(C3=CC=CC=C3)O
InChI
InChI=1S/C21H19NO2/c22-20(23)19(16-10-4-1-5-11-16)21(24,17-12-6-2-7-13-17)18-14-8-3-9-15-18/h1-15,19,24H,(H2,22,23)
InChIKey
FENCJTICALSGLA-UHFFFAOYSA-N
Compound name
3-hydroxy-2,3,3-triphenylpropanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

317.14157 Da
Monoisotopic Mass

3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 318.148846 175.1
[M+Na]+ 340.130788 178.5
[M-H]- 316.134294 182.1
[M+NH4]+ 335.175393 186.7
[M+K]+ 356.104728 173.3
[M+H-H2O]+ 300.138830 166.2
[M+HCOO]- 362.139771 194.2
[M+CH3COO]- 376.155421 206.3
[M+Na-2H]- 338.116236 179.3
[M]+ 317.14102142 170.7
[M]- 317.14211858 170.7
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.