CID 3068542

N,2-diphenyl-n-(phenylacetyl)glycine

Structural Information

Molecular Formula
C22H19NO3
SMILES
C1=CC=C(C=C1)CC(=O)N(C2=CC=CC=C2)C(C3=CC=CC=C3)C(=O)O
InChI
InChI=1S/C22H19NO3/c24-20(16-17-10-4-1-5-11-17)23(19-14-8-3-9-15-19)21(22(25)26)18-12-6-2-7-13-18/h1-15,21H,16H2,(H,25,26)
InChIKey
PMIDFFWDKPBWLC-UHFFFAOYSA-N
Compound name
2-phenyl-2-(N-(2-phenylacetyl)anilino)acetic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

345.1365 Da
Monoisotopic Mass

4.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 346.14378 182.4
[M+Na]+ 368.12572 184.8
[M-H]- 344.12922 190.9
[M+NH4]+ 363.17032 193.4
[M+K]+ 384.09966 181.3
[M+H-H2O]+ 328.13376 172.4
[M+HCOO]- 390.13470 203.2
[M+CH3COO]- 404.15035 214.2
[M+Na-2H]- 366.11117 184.3
[M]+ 345.13595 181.0
[M]- 345.13705 181.0
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.