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Sulforaphane nitrile
SpectraBase Compound ID JJVBOF6mxZL
InChI InChI=1S/C6H11NOS/c1-9(8)6-4-2-3-5-7/h2-4,6H2,1H3
InChIKey FGYQUFZANKOISC-UHFFFAOYSA-N
Mol Weight 145.22 g/mol
Molecular Formula C6H11NOS
Exact Mass 145.056135 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4N3hxuBIBAi
Name 4-Cyanobuty methyl sulfoxide
CAS Registry Number 61121-66-2
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C6H11NOS
InChI InChI=1S/C6H11NOS/c1-9(8)6-4-2-3-5-7/h2-4,6H2,1H3
InChIKey FGYQUFZANKOISC-UHFFFAOYSA-N
Molecular Weight 145.220 g/mol
SMILES C(#N)CCCCS(=O)C
SPLASH splash10-0a4i-9100000000-e939f08b71f4e214be55
Source of Spectrum QC-8-695-15
Synonyms 5-Methylsulfinylpentanenitrile
Wiley ID 869846