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N-Acetyl-.alpha.-[1'-mercaptocyclopropyl)glycine - methyl ester
SpectraBase Compound ID 9L66DIkOBCu
InChI InChI=1S/C8H13NO3S/c1-5(10)9-6(7(11)12-2)8(13)3-4-8/h6,13H,3-4H2,1-2H3,(H,9,10)
InChIKey PPSAQHJUSXRROQ-UHFFFAOYSA-N
Mol Weight 203.26 g/mol
Molecular Formula C8H13NO3S
Exact Mass 203.061614 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Johb0ty4i6O
Name N-Acetyl-.alpha.-[1'-mercaptocyclopropyl)glycine - methyl ester
Alternate Name(s) Methyl 2-acetamido-2-(1-sulfanylcyclopropyl)acetate Methyl 2-acetamido-2-(1-sulfanylcyclopropyl)ethanoate
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Formula C8H13NO3S
InChI InChI=1S/C8H13NO3S/c1-5(10)9-6(7(11)12-2)8(13)3-4-8/h6,13H,3-4H2,1-2H3,(H,9,10)
InChIKey PPSAQHJUSXRROQ-UHFFFAOYSA-N
Molecular Weight 203.256 g/mol
SMILES N(C(C1(CC1)S)C(=O)OC)C(=O)C
SPLASH splash10-0uk9-0690000000-958a02784377d22e9b55
Source of Spectrum K1-2001-3029-6
Wiley ID 814106