CID 137526050

(4s)-n-[(3s)-2,6-dioxopiperidin-3-yl]-1,2,3,4-tetrahydroquinoline-4-carboxamide

Structural Information

Molecular Formula
C15H17N3O3
SMILES
C1CC(=O)NC(=O)[C@H]1NC(=O)[C@H]2CCNC3=CC=CC=C23
InChI
InChI=1S/C15H17N3O3/c19-13-6-5-12(15(21)18-13)17-14(20)10-7-8-16-11-4-2-1-3-9(10)11/h1-4,10,12,16H,5-8H2,(H,17,20)(H,18,19,21)/t10-,12-/m0/s1
InChIKey
CTVJOMHYRHQHLU-JQWIXIFHSA-N
Compound name
(4S)-N-[(3S)-2,6-dioxopiperidin-3-yl]-1,2,3,4-tetrahydroquinoline-4-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

8
Patents

287.12698 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 288.13426 166.4
[M+Na]+ 310.11620 176.0
[M+NH4]+ 305.16080 172.2
[M+K]+ 326.09014 170.8
[M-H]- 286.11970 167.8
[M+Na-2H]- 308.10165 169.6
[M]+ 287.12643 167.6
[M]- 287.12753 167.6
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

patents stripe