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ACETIC ACID, 5-ACETOXY-4-NITRO-TETRAHYDRO-THIOPYRAN-3-YL ESTER
SpectraBase Compound ID BjusqtHx5CK
InChI InChI=1S/C9H14O4S.NO2/c1-6(10)12-8-3-9(5-14-4-8)13-7(2)11;2-1-3/h8-9H,3-5H2,1-2H3;
InChIKey BKJFIHDGTNPZBZ-UHFFFAOYSA-N
Mol Weight 265.28 g/mol
Molecular Formula C9H15NO6S
Exact Mass 265.062008 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BnTIIFSCPFA
Name ACETIC ACID, 5-ACETOXY-4-NITRO-TETRAHYDRO-THIOPYRAN-3-YL ESTER
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C9H13NO6S
InChI InChI=1S/C9H14O4S.NO2/c1-6(10)12-8-3-9(5-14-4-8)13-7(2)11;2-1-3/h8-9H,3-5H2,1-2H3;
InChIKey BKJFIHDGTNPZBZ-UHFFFAOYSA-N
Molecular Weight 265.0616
SMILES N(=O)=O.C1C(OC(C)=O)CSCC1OC(C)=O
SPLASH splash10-0007-9200000000-edddd596c6466570f94f
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany