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S-N-BUTYL-(E)-1-PROPENETHIOSULFINATE

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S-N-BUTYL-(E)-1-PROPENETHIOSULFINATE
SpectraBase Compound ID GwS1Lr9AwHP
InChI InChI=1S/C7H14OS2/c1-3-5-6-9-10(8)7-4-2/h4,7H,3,5-6H2,1-2H3/b7-4+
InChIKey ZCGVTIFFCRCYJF-QPJJXVBHSA-N
Mol Weight 178.31 g/mol
Molecular Formula C7H14OS2
Exact Mass 178.048607 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5Bn1IbPt1Ty
Name S-N-BUTYL-(E)-1-PROPENETHIOSULFINATE
Compound Number 8
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C7H14OS2
InChI InChI=1S/C7H14OS2/c1-3-5-6-9-10(8)7-4-2/h4,7H,3,5-6H2,1-2H3/b7-4+
InChIKey ZCGVTIFFCRCYJF-QPJJXVBHSA-N
Literature Reference Author R.KUBEC,S.KIM,D.M.MCKEON,R.A.MUSAH
Literature Reference Citation J.NAT.PROD.,65,960(2002)
Literature Reference DOI 10.1021/np020064i
Molecular Weight 178.308 g/mol
Solvent CDCl3
Source File Reference UWSI4340