CID 14306898

93823-63-3

Structural Information

Molecular Formula
C20H29N3O3
SMILES
CC1(C=C(C(N1)(C)C)C(=O)NCCCNC(=O)C(C2=CC=CC=C2)O)C
InChI
InChI=1S/C20H29N3O3/c1-19(2)13-15(20(3,4)23-19)17(25)21-11-8-12-22-18(26)16(24)14-9-6-5-7-10-14/h5-7,9-10,13,16,23-24H,8,11-12H2,1-4H3,(H,21,25)(H,22,26)
InChIKey
ABGNBZYWJINTLG-UHFFFAOYSA-N
Compound name
N-[3-[(2-hydroxy-2-phenylacetyl)amino]propyl]-2,2,5,5-tetramethyl-1H-pyrrole-3-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

359.2209 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 360.22818 186.8
[M+Na]+ 382.21012 193.1
[M+NH4]+ 377.25472 193.6
[M+K]+ 398.18406 187.3
[M-H]- 358.21362 187.4
[M+Na-2H]- 380.19557 192.3
[M]+ 359.22035 187.6
[M]- 359.22145 187.6
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

No patent data available for this compound.