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2-(3-Methoxy-4-hydroxy-5-nitrophenyl)-1,3-dithiane
SpectraBase Compound ID A77GF6EPMCI
InChI InChI=1S/C11H13NO4S2/c1-16-9-6-7(11-17-3-2-4-18-11)5-8(10(9)13)12(14)15/h5-6,11,13H,2-4H2,1H3
InChIKey YERBEJNLXVYBTP-UHFFFAOYSA-N
Mol Weight 287.35 g/mol
Molecular Formula C11H13NO4S2
Exact Mass 287.0286 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DarWlVbZTcF
Name 2-(3-Methoxy-4-hydroxy-5-nitrophenyl)-1,3-dithiane
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H13NO4S2
InChI InChI=1S/C11H13NO4S2/c1-16-9-6-7(11-17-3-2-4-18-11)5-8(10(9)13)12(14)15/h5-6,11,13H,2-4H2,1H3
InChIKey YERBEJNLXVYBTP-UHFFFAOYSA-N
Molecular Weight 287.348 g/mol
SMILES Oc1c(cc(C2SCCCS2)cc1N(=O)=O)OC
SPLASH splash10-01p9-0390000000-e945171ae0cb196dbf0b
Source of Spectrum KC-0-967-5
Synonyms 4-(1,3-dithian-2-yl)-2-methoxy-6-nitrophenol
Wiley ID 824583