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(E)-S-hex-2-en-1-yl benzylcarbamothioate
SpectraBase Compound ID CrTIpwZjXSl
InChI InChI=1S/C14H19NOS/c1-2-3-4-8-11-17-14(16)15-12-13-9-6-5-7-10-13/h4-10H,2-3,11-12H2,1H3,(H,15,16)/b8-4+
InChIKey NXVOOYOOZZQUIB-XBXARRHUSA-N
Mol Weight 249.37 g/mol
Molecular Formula C14H19NOS
Exact Mass 249.118735 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1KPrjnzccku
Name (E)-S-hex-2-en-1-yl benzylcarbamothioate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H19NOS
InChI InChI=1S/C14H19NOS/c1-2-3-4-8-11-17-14(16)15-12-13-9-6-5-7-10-13/h4-10H,2-3,11-12H2,1H3,(H,15,16)/b8-4+
InChIKey NXVOOYOOZZQUIB-XBXARRHUSA-N
Literature Reference DOI 10.1021/jo1006152
Molecular Weight 249.372 g/mol
SMILES N(C(SC\C=C\CCC)=O)Cc1ccccc1
SPLASH splash10-00kf-9300000000-d045e48a62d42fab4b85
Source of Spectrum J-75-4615/SMS19-3l
Synonyms N-(phenylmethyl)carbamothioic acid S-[(E)-hex-2-enyl] ester S-[(E)-hex-2-enyl] N-benzylcarbamothioate S-[(E)-hex-2-enyl] N-(phenylmethyl)carbamothioate
Wiley ID 1751683