CID 991033

314750-66-8

Structural Information

Molecular Formula
C24H24N2O3
SMILES
COC1=CC=C(C=C1)C(NC(=O)CC2=CC=CC=C2)NC(=O)CC3=CC=CC=C3
InChI
InChI=1S/C24H24N2O3/c1-29-21-14-12-20(13-15-21)24(25-22(27)16-18-8-4-2-5-9-18)26-23(28)17-19-10-6-3-7-11-19/h2-15,24H,16-17H2,1H3,(H,25,27)(H,26,28)
InChIKey
YJSDMQHDAOUJBO-UHFFFAOYSA-N
Compound name
N-[(4-methoxyphenyl)-[(2-phenylacetyl)amino]methyl]-2-phenylacetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

5
Patents

388.17868 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 389.18596 194.8
[M+Na]+ 411.16790 196.6
[M-H]- 387.17140 203.1
[M+NH4]+ 406.21250 204.0
[M+K]+ 427.14184 192.4
[M+H-H2O]+ 371.17594 184.0
[M+HCOO]- 433.17688 216.9
[M+CH3COO]- 447.19253 224.8
[M+Na-2H]- 409.15335 196.7
[M]+ 388.17813 194.2
[M]- 388.17923 194.2
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