CID 131770052

Chebi:169696

Structural Information

Molecular Formula
C15H19N3O3
SMILES
CC(=O)NC1CCC2C(C1)C3=C(N2)C(=CC(=C3)C(=O)N)O
InChI
InChI=1S/C15H19N3O3/c1-7(19)17-9-2-3-12-10(6-9)11-4-8(15(16)21)5-13(20)14(11)18-12/h4-5,9-10,12,18,20H,2-3,6H2,1H3,(H2,16,21)(H,17,19)
InChIKey
CDCOGHQILPZANE-UHFFFAOYSA-N
Compound name
6-acetamido-1-hydroxy-5,6,7,8,8a,9-hexahydro-4bH-carbazole-3-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

289.14264 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 290.149916 164.9
[M+Na]+ 312.131858 170.1
[M-H]- 288.135364 165.5
[M+NH4]+ 307.176463 180.8
[M+K]+ 328.105798 165.7
[M+H-H2O]+ 272.139900 158.7
[M+HCOO]- 334.140841 179.5
[M+CH3COO]- 348.156491 203.9
[M+Na-2H]- 310.117306 165.1
[M]+ 289.14209142 158.7
[M]- 289.14318858 158.7
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.