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2-Methyl-1,2,3,4-tetrahydro-β-carboline
SpectraBase Compound ID LGg3O5EaDXb
InChI InChI=1S/C12H14N2/c1-14-7-6-10-9-4-2-3-5-11(9)13-12(10)8-14/h2-5,13H,6-8H2,1H3
InChIKey JOFKCNJIUXPJAC-UHFFFAOYSA-N
Mol Weight 186.26 g/mol
Molecular Formula C12H14N2
Exact Mass 186.115698 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8JpNfz9Y1ku
Name 2-Methyl-1,2,3,4-tetrahydro-beta-carboline
CAS Registry Number 13100-00-0
Classification Pharmaceutical drug, antidepressive MAO inhibitor
Comments Spectrum verified by crosschecking against external libraries (one reference spectrum with similarity >= 99% found)
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 186.115698459 u
Formula C12H14N2
InChI InChI=1S/C12H14N2/c1-14-7-6-10-9-4-2-3-5-11(9)13-12(10)8-14/h2-5,13H,6-8H2,1H3
InChIKey JOFKCNJIUXPJAC-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 186.258 g/mol
Nominal Mass 186 u
Quality 994
Retention Index 1567
SMILES C1=2C=3C(NC2CN(CC1)C)=CC=CC3
SPLASH splash10-0006-1900000000-0a01703493c524fdb18c
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms 2-Methyl-2,3,4,9-tetrahydro-1H-beta.carboline 2-Methyl-1,3,4,9-tetrahydropyrido[3,4-b]indole
Technique GC/MS
Wiley ID DD2024_022574