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2-Butoxy-1-phenylthiocyclopropanecarbonitrile
SpectraBase Compound ID 58BFt8GW90I
InChI InChI=1S/C14H17NOS/c1-2-3-9-16-13-10-14(13,11-15)17-12-7-5-4-6-8-12/h4-8,13H,2-3,9-10H2,1H3
InChIKey KRFXAEUGKDLCBF-UHFFFAOYSA-N
Mol Weight 247.36 g/mol
Molecular Formula C14H17NOS
Exact Mass 247.103085 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID H5CK0RZ8SzA
Name 2-Butoxy-1-phenylthiocyclopropanecarbonitrile
Alternate Name(s) 2-Butoxy-1-(phenylsulfanyl)cyclopropanecarbonitrile cis-2-Butoxy-1-phenylthiocyclopropanecarbonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H17NOS
InChI InChI=1S/C14H17NOS/c1-2-3-9-16-13-10-14(13,11-15)17-12-7-5-4-6-8-12/h4-8,13H,2-3,9-10H2,1H3
InChIKey KRFXAEUGKDLCBF-UHFFFAOYSA-N
Molecular Weight 247.356 g/mol
SMILES C1(CC1OCCCC)(C#N)Sc1ccccc1
SPLASH splash10-03dl-0910000000-6acdaf001941d8f48055
Source of Spectrum QA-41-807-4
Wiley ID 861899