Debug Info

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EHaKP4zQXGf
spectrumID
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EHaKP4zQXGf
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Mass Spectrum (GC)
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2-Methylpropyl .beta.-styryl sulfide
SpectraBase Compound ID Ey4zRr6OG9w
InChI InChI=1S/C12H16S/c1-11(2)10-13-9-8-12-6-4-3-5-7-12/h3-9,11H,10H2,1-2H3/b9-8+
InChIKey VTSPQXUPQSZCGM-CMDGGOBGSA-N
Mol Weight 192.32 g/mol
Molecular Formula C12H16S
Exact Mass 192.097272 g/mol
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Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EHaKP4zQXGf
Name 2-Methylpropyl .beta.-styryl sulfide
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H16S
InChI InChI=1S/C12H16S/c1-11(2)10-13-9-8-12-6-4-3-5-7-12/h3-9,11H,10H2,1-2H3/b9-8+
InChIKey VTSPQXUPQSZCGM-CMDGGOBGSA-N
Molecular Weight 192.320 g/mol
SMILES c1(\C=C\SCC(C)C)ccccc1
SPLASH splash10-000i-0900000000-961a1f1eacf59dbe6bda
Source of Spectrum J-61-6787-20
Synonyms isobutyl (E)-2-phenylethenyl sulfide [(E)-2-(isobutylsulfanyl)ethenyl]benzene
Wiley ID 1188874
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