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(E)-S-(3-(4-methoxyphenyl)allyl) butylcarbamothioate
SpectraBase Compound ID 1LMvG5qWJQv
InChI InChI=1S/C15H21NO2S/c1-3-4-11-16-15(17)19-12-5-6-13-7-9-14(18-2)10-8-13/h5-10H,3-4,11-12H2,1-2H3,(H,16,17)/b6-5+
InChIKey JZSRZINRCXEWBH-AATRIKPKSA-N
Mol Weight 279.4 g/mol
Molecular Formula C15H21NO2S
Exact Mass 279.1293 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IZU2KwzJF6Q
Name (E)-S-(3-(4-methoxyphenyl)allyl) butylcarbamothioate
Alternate Name(s) N-butylcarbamothioic acid S-[(E)-3-(4-methoxyphenyl)prop-2-enyl] ester S-[(E)-3-(4-methoxyphenyl)allyl] N-butylcarbamothioate S-[(E)-3-(4-methoxyphenyl)prop-2-enyl] N-butylcarbamothioate
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Formula C15H21NO2S
InChI InChI=1S/C15H21NO2S/c1-3-4-11-16-15(17)19-12-5-6-13-7-9-14(18-2)10-8-13/h5-10H,3-4,11-12H2,1-2H3,(H,16,17)/b6-5+
InChIKey JZSRZINRCXEWBH-AATRIKPKSA-N
Literature Reference DOI 10.1021/jo1006152
Molecular Weight 279.398 g/mol
SMILES N(C(SC\C=C\c1ccc(cc1)OC)=O)CCCC
SPLASH splash10-0002-2910000000-6258f160914536c000bd
Source of Spectrum J-75-4615/SMS13-3e
Wiley ID 1751676