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S-hex-1-en-3-yl benzylcarbamothioate

View entire compound with spectra: 1 MS (GC)

S-hex-1-en-3-yl benzylcarbamothioate
SpectraBase Compound ID FTopEV2DKfd
InChI InChI=1S/C14H19NOS/c1-3-8-13(4-2)17-14(16)15-11-12-9-6-5-7-10-12/h4-7,9-10,13H,2-3,8,11H2,1H3,(H,15,16)
InChIKey QKADEUQDGONATB-UHFFFAOYSA-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 GRr6Im2RlIY
Name S-hex-1-en-3-yl benzylcarbamothioate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H19NOS
InChI InChI=1S/C14H19NOS/c1-3-8-13(4-2)17-14(16)15-11-12-9-6-5-7-10-12/h4-7,9-10,13H,2-3,8,11H2,1H3,(H,15,16)
InChIKey QKADEUQDGONATB-UHFFFAOYSA-N
Literature Reference DOI 10.1021/jo1006152
Molecular Weight 249.372 g/mol
SMILES N(C(SC(CCC)C=C)=O)Cc1ccccc1
SPLASH splash10-00kf-9200000000-8854c99bab8687cc550c
Source of Spectrum J-75-4615/SMS19-2l
Wiley ID 1751671