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3a,7,7-Trichloro-5-methyl-3,3a,4,5,6,7-hexahydro-2H-indole
SpectraBase Compound ID D1sWdSRCGyK
InChI InChI=1S/C9H12Cl3N/c1-6-4-8(10)2-3-13-7(8)9(11,12)5-6/h6H,2-5H2,1H3
InChIKey UGVRMQAIRSSKGU-UHFFFAOYSA-N
Mol Weight 240.56 g/mol
Molecular Formula C9H12Cl3N
Exact Mass 239.003532 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BzZ3eUPb6gp
Name 3a,7,7-Trichloro-5-methyl-3,3a,4,5,6,7-hexahydro-2H-indole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H12Cl3N
InChI InChI=1S/C9H12Cl3N/c1-6-4-8(10)2-3-13-7(8)9(11,12)5-6/h6H,2-5H2,1H3
InChIKey UGVRMQAIRSSKGU-UHFFFAOYSA-N
Molecular Weight 240.561 g/mol
SMILES C=12C(CC(CC2(CCN1)Cl)C)(Cl)Cl
SPLASH splash10-0uxr-8790000000-ed9ace1492cdd0b82680
Source of Spectrum F-52-3713-4
Synonyms 3a,7,7-Trichloro-5-methyl-3,3a,4,5,6,7-hexahydro-2H-indole isomer
Wiley ID 795672