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3,4,4-Trimethyl-2,8-dinitro-4H-thieno[3,2-c]benzopyran
SpectraBase Compound ID ENAeiihzS1e
InChI InChI=1S/C14H12N2O5S/c1-7-11-12(22-13(7)16(19)20)9-6-8(15(17)18)4-5-10(9)21-14(11,2)3/h4-6H,1-3H3
InChIKey WJIGDPUXALROOZ-UHFFFAOYSA-N
Mol Weight 320.32 g/mol
Molecular Formula C14H12N2O5S
Exact Mass 320.046693 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9obD9z02zvA
Name 3,4,4-Trimethyl-2,8-dinitro-4H-thieno[3,2-c]benzopyran
Comments Less than 3 mono-isotopic peaks
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Formula C14H12N2O5S
InChI InChI=1S/C14H12N2O5S/c1-7-11-12(22-13(7)16(19)20)9-6-8(15(17)18)4-5-10(9)21-14(11,2)3/h4-6H,1-3H3
InChIKey WJIGDPUXALROOZ-UHFFFAOYSA-N
Molecular Weight 320.319 g/mol
SMILES c1(c(c2C(Oc3c(-c2s1)cc(N(=O)=O)cc3)(C)C)C)N(=O)=O
SPLASH splash10-0a4i-0009000000-272a9e3050f797fb4e9e
Source of Spectrum H1-55-2382-23
Synonyms 3,4,4-trimethyl-2,8-dinitro-4H-thieno[3,2-c]chromene
Wiley ID 1564750