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4,4'-[Sulfanediylbis(3-nitro-2,4-thienediyl)]dimorpholine
SpectraBase Compound ID BcEdeeYY2Us
InChI InChI=1S/C16H18N4O6S3/c21-19(22)13-11(17-1-5-25-6-2-17)9-27-15(13)29-16-14(20(23)24)12(10-28-16)18-3-7-26-8-4-18/h9-10H,1-8H2
InChIKey GCMZPJVXQWFBID-UHFFFAOYSA-N
Mol Weight 458.52 g/mol
Molecular Formula C16H18N4O6S3
Exact Mass 458.038848 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3LTXKeLOjjc
Name 4,4'-[Sulfanediylbis(3-nitro-2,4-thienediyl)]dimorpholine
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Formula C16H18N4O6S3
InChI InChI=1S/C16H18N4O6S3/c21-19(22)13-11(17-1-5-25-6-2-17)9-27-15(13)29-16-14(20(23)24)12(10-28-16)18-3-7-26-8-4-18/h9-10H,1-8H2
InChIKey GCMZPJVXQWFBID-UHFFFAOYSA-N
Molecular Weight 458.522 g/mol
SMILES c1(c(Sc2c(c(N3CCOCC3)cs2)N(=O)=O)scc1N1CCOCC1)N(=O)=O
SPLASH splash10-0a4j-3900100000-b2d8893725f30f050bde
Source of Spectrum U1-2013-4291-11
Synonyms Bis(4-morpholino-3-nitrothiophen-2-yl)sulfane 4-[5-[[4-(4-morpholinyl)-3-nitro-2-thiophenyl]thio]-4-nitro-3-thiophenyl]morpholine 4-[5-(4-morpholin-4-yl-3-nitrothiophen-2-yl)sulfanyl-4-nitrothiophen-3-yl]morpholine 4-[5-[(4-morpholino-3-nitro-2-thienyl)sulfanyl]-4-nitro-3-thienyl]morpholine 4-[5-(4-morpholin-4-yl-3-nitro-thiophen-2-yl)sulfanyl-4-nitro-thiophen-3-yl]morpholine
Wiley ID 1736015