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1-{[4',5'-bis(Methoxycarbonyl)-1',3'-dithiafulven-2'-yl]methyl}-2-spiro[4',5'-bis(methoxycarbonyl)-1',3'-dithiafulvene]-]indane

View entire compound with spectra: 1 MS (GC)

1-{[4',5'-bis(Methoxycarbonyl)-1',3'-dithiafulven-2'-yl]methyl}-2-spiro[4',5'-bis(methoxycarbonyl)-1',3'-dithiafulvene]-]indane
SpectraBase Compound ID 5wNs2rdWvna
InChI InChI=1S/C22H18O8S4/c1-27-17(23)13-14(18(24)28-2)32-21(31-13)12-11-8-6-5-7-10(11)9-22(12)33-15(19(25)29-3)16(34-22)20(26)30-4/h5-8H,9H2,1-4H3
InChIKey GSMUXTAKVDMUTF-UHFFFAOYSA-N
Mol Weight 538.6 g/mol
Molecular Formula C22H18O8S4
Exact Mass 537.988452 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3x7PL9XVWGq
Name 1-{[4',5'-bis(Methoxycarbonyl)-1',3'-dithiafulven-2'-yl]methyl}-2-spiro[4',5'-bis(methoxycarbonyl)-1',3'-dithiafulvene]-]indane
Alternate Name(s) 4,5-Dimethyl 1'-[4,5-bis(methoxycarbonyl)-2H-1,3-dithiol-2-ylidene]-1',3'-dihydrospiro[1,3-dithiole-2,2'-indene]-4,5-dicarboxylate
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Formula C22H18O8S4
InChI InChI=1S/C22H18O8S4/c1-27-17(23)13-14(18(24)28-2)32-21(31-13)12-11-8-6-5-7-10(11)9-22(12)33-15(19(25)29-3)16(34-22)20(26)30-4/h5-8H,9H2,1-4H3
InChIKey GSMUXTAKVDMUTF-UHFFFAOYSA-N
Molecular Weight 538.618 g/mol
SMILES C12(C(=C3SC(C(=O)OC)=C(S3)C(=O)OC)c3ccccc3C1)SC(C(=O)OC)=C(S2)C(=O)OC
SPLASH splash10-0zgi-0505590000-3293e010f4edb9b10f16
Source of Spectrum O-29-571-4
Wiley ID 1404262