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(Z)-3-(4-nitrobenzylidene)dihydro-2H-thiopyran-4(3H)-one
SpectraBase Compound ID 6XA9F5TpDww
InChI InChI=1S/C12H11NO3S/c14-12-5-6-17-8-10(12)7-9-1-3-11(4-2-9)13(15)16/h1-4,7H,5-6,8H2/b10-7+
InChIKey ASYPTKOUHDVDFI-JXMROGBWSA-N
Mol Weight 249.28 g/mol
Molecular Formula C12H11NO3S
Exact Mass 249.045964 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FnFXWdZeunq
Name (Z)-3-(4-nitrobenzylidene)dihydro-2H-thiopyran-4(3H)-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H11NO3S
InChI InChI=1S/C12H11NO3S/c14-12-5-6-17-8-10(12)7-9-1-3-11(4-2-9)13(15)16/h1-4,7H,5-6,8H2/b10-7+
InChIKey ASYPTKOUHDVDFI-JXMROGBWSA-N
Literature Reference DOI 10.1080/00397911.2013.786089
Molecular Weight 249.284 g/mol
SMILES C1C(\C(CSC1)=C\c1ccc(cc1)[N+](=O)[O-])=O
SPLASH splash10-001i-9100000000-993572c93961eb38f056
Source of Spectrum B1-43-3357/SM21-A7
Wiley ID 1757515