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2-[(E)-1-methyl-2-nitro-prop-1-enyl]sulfanylethanol
SpectraBase Compound ID 4yL5gHcWxbI
InChI InChI=1S/C6H11NO3S/c1-5(7(9)10)6(2)11-4-3-8/h8H,3-4H2,1-2H3/b6-5+
InChIKey FETIQEWDISYDIP-AATRIKPKSA-N
Mol Weight 177.22 g/mol
Molecular Formula C6H11NO3S
Exact Mass 177.045964 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CBe2aH5No8A
Name 2-[(E)-1-methyl-2-nitro-prop-1-enyl]sulfanylethanol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C6H11NO3S
InChI InChI=1S/C6H11NO3S/c1-5(7(9)10)6(2)11-4-3-8/h8H,3-4H2,1-2H3/b6-5+
InChIKey FETIQEWDISYDIP-AATRIKPKSA-N
Molecular Weight 177.218 g/mol
SMILES OCCS\C(=C/(N(=O)=O)C)C
SPLASH splash10-0r99-9100000000-af3f6382031ef011929e
Source of Spectrum J-59-1056-10
Synonyms 2-[(E)-3-nitrobut-2-en-2-yl]sulfanylethanol 2-[[(E)-1-methyl-2-nitro-prop-1-enyl]thio]ethanol 2-[[(E)-3-nitrobut-2-en-2-yl]thio]ethanol
Wiley ID 1172964