CID 14458352

93799-05-4

Structural Information

Molecular Formula
C20H25N3O4
SMILES
CC1(C=C(C(N1)(C)C)C(=O)NCC(CN2C(=O)C3=CC=CC=C3C2=O)O)C
InChI
InChI=1S/C20H25N3O4/c1-19(2)9-15(20(3,4)22-19)16(25)21-10-12(24)11-23-17(26)13-7-5-6-8-14(13)18(23)27/h5-9,12,22,24H,10-11H2,1-4H3,(H,21,25)
InChIKey
ZCFVMRSSDATJKL-UHFFFAOYSA-N
Compound name
N-[3-(1,3-dioxoisoindol-2-yl)-2-hydroxypropyl]-2,2,5,5-tetramethyl-1H-pyrrole-3-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

371.1845 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 372.19178 186.7
[M+Na]+ 394.17372 194.0
[M+NH4]+ 389.21832 193.4
[M+K]+ 410.14766 190.5
[M-H]- 370.17722 186.1
[M+Na-2H]- 392.15917 190.0
[M]+ 371.18395 187.2
[M]- 371.18505 187.2
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

No patent data available for this compound.