SpectraBase Spectrum ID |
JEcVF6bJQMC |
Name |
(5-Allyl-2-cyclopentyl-2,3,4,5-tetrahydro-1H-pyrido[4,3-b]indol-8-yl)(4-methylpiperidin-1-yl)methanone |
Classification |
Chemical |
Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
405.278012758 u |
Formula |
C26H35N3O |
InChI |
InChI=1S/C26H35N3O/c1-3-13-29-24-9-8-20(26(30)27-14-10-19(2)11-15-27)17-22(24)23-18-28(16-12-25(23)29)21-6-4-5-7-21/h3,8-9,17,19,21H,1,4-7,10-16,18H2,2H3 |
InChIKey |
IKGRGZBGVAOKOU-UHFFFAOYSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
405.586 g/mol |
Nominal Mass |
405 u |
Quality |
576 |
Retention Index |
3283 |
SMILES |
C=12C3=C(N(C2=CC=C(C1)C(N1CCC(CC1)C)=O)CC=C)CCN(C3)C1CCCC1 |
SPLASH |
splash10-0a4i-0349400000-6ce8675d3d0b6a5a7f07 |
Source of Spectrum |
DigiLab GmbH (C) 2024 |
Synonyms |
(2-cyclopentyl-5-(prop-2-en-1-yl)-2,3,4,5-tetrahydro-1H-pyrido[4,3-b]indol-8-yl)(4-methylpiperidin-\r1-yl)methanone |
Technique |
GC/MS |
Wiley ID |
DD2024_018719 |