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(3aR,8bS)-8b-methyl-2,3,3a,4-tetrahydro-1H-pyrrolo[2,3-b]indole
SpectraBase Compound ID GMZhrdkACxZ
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
Mol Weight 174.25 g/mol
Molecular Formula C11H14N2
Exact Mass 174.115698 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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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