| SpectraBase Spectrum ID |
5GW5FWPCtxo |
| Name |
(6ar,10As,10BS)-2-methyl-4,6,6A,7,8,9,10,10B-octahydro-3H-pyrido[2,1-A]isoindol-10A-ol |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
207.162314299 u |
| Formula |
C13H21NO |
| InChI |
InChI=1S/C13H21NO/c1-10-5-7-14-9-11-4-2-3-6-13(11,15)12(14)8-10/h8,11-12,15H,2-7,9H2,1H3/t11-,12+,13+/m1/s1 |
| InChIKey |
CQINAYFKZFDUST-AGIUHOORSA-N |
| Molecular Weight |
207.317 g/mol |
| SMILES |
[C@@]12(N(C[C@]3(CCCC[C@@]23O)[H])CCC(=C1)C)[H] |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.833714 |
![(6aR,10aS,10bS)-2-methyl-4,6,6a,7,8,9,10,10b-octahydro-3H-pyrido[2,1-a]isoindol-10a-ol](/api/spectrum/5GW5FWPCtxo/structure.png?h=300&w=458 "(6aR,10aS,10bS)-2-methyl-4,6,6a,7,8,9,10,10b-octahydro-3H-pyrido[2,1-a]isoindol-10a-ol")
