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6-Bromo-7-(phenylthio)-1,2,3,5,8,8a-hexahydro-5-indolizinone
SpectraBase Compound ID CYTCSl5v2CP
InChI InChI=1S/C14H14BrNOS/c15-13-12(18-11-6-2-1-3-7-11)9-10-5-4-8-16(10)14(13)17/h1-3,6-7,10H,4-5,8-9H2
InChIKey BJHLORAMNUBFQO-UHFFFAOYSA-N
Mol Weight 324.24 g/mol
Molecular Formula C14H14BrNOS
Exact Mass 322.997948 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID F2lMuiXbL54
Name 6-Bromo-7-(phenylthio)-1,2,3,5,8,8a-hexahydro-5-indolizinone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H14BrNOS
InChI InChI=1S/C14H14BrNOS/c15-13-12(18-11-6-2-1-3-7-11)9-10-5-4-8-16(10)14(13)17/h1-3,6-7,10H,4-5,8-9H2
InChIKey BJHLORAMNUBFQO-UHFFFAOYSA-N
Literature Reference DOI 10.1021/jo102092b
Molecular Weight 324.236 g/mol
SMILES C1C2N(C(C(=C1Sc1ccccc1)Br)=O)CCC2
SPLASH splash10-00bc-0269000000-3af0773e005601746d00
Source of Spectrum J-76-692/SMS6-13a
Synonyms 6-Bromo-7-(phenylthio)-2,3,8,8a-tetrahydroindolizin-5(1H)-one 6-Bromo-7-phenylsulfanyl-2,3,8,8a-tetrahydro-1H-indolizin-5-one 6-Bromanyl-7-phenylsulfanyl-2,3,8,8a-tetrahydro-1H-indolizin-5-one
Wiley ID 1751860