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3a-(1,3-benzodioxol-5-yl)-2,3,4,5,6,7-hexahydroindole
SpectraBase Compound ID Lq3wRdrAOJU
InChI InChI=1S/C15H17NO2/c1-2-6-15(7-8-16-14(15)3-1)11-4-5-12-13(9-11)18-10-17-12/h4-5,9H,1-3,6-8,10H2
InChIKey SJIYFWWRYXSOOU-UHFFFAOYSA-N
Mol Weight 243.31 g/mol
Molecular Formula C15H17NO2
Exact Mass 243.125929 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 77uVHcaAyyO
Name 3a-(1,3-benzodioxol-5-yl)-2,3,4,5,6,7-hexahydroindole
CAS Registry Number 109535-43-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H17NO2
InChI InChI=1S/C15H17NO2/c1-2-6-15(7-8-16-14(15)3-1)11-4-5-12-13(9-11)18-10-17-12/h4-5,9H,1-3,6-8,10H2
InChIKey SJIYFWWRYXSOOU-UHFFFAOYSA-N
Molecular Weight 243.306 g/mol
SMILES C12(c3cc4OCOc4cc3)C(=NCC2)CCCC1
SPLASH splash10-0007-6390000000-b5f39ba060aa1a3b79d1
Source of Spectrum F-52-3114-12
Synonyms 3a-(1,3-Benzodioxol-5-yl)-3,3a,4,5,6,7-hexahydro-2H-indole 3a-(3,4-Methylenedioxy)-hexahydroindole 3a-(3,4-Methylenedioxy)phenylhexahydroindole
Wiley ID 795370