SpectraBase Spectrum ID |
5CHYdbA9XHE |
Name |
(3ar,8bs)-8B-Methyl-2,3,3A,4-tetrahydro-1H-pyrrolo[2,3-B]indole |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
174.115698459 u |
Formula |
C11H14N2 |
InChI |
InChI=1S/C11H14N2/c1-11-6-7-12-10(11)13-9-5-3-2-4-8(9)11/h2-5,10,12-13H,6-7H2,1H3/t10-,11+/m1/s1 |
InChIKey |
QREOKCMNEWNKLU-MNOVXSKESA-N |
Molecular Weight |
174.247 g/mol |
SMILES |
[C@]12([C@](C3=CC=CC=C3N2)(CCN1)C)[H] |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.883085 |