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(E)-Methyl 3-(1,3-dithian-2-ylidene)-3-((4-phenoxyphenyl)diazenyl)propanoate
SpectraBase Compound ID KsIB43foAB6
InChI InChI=1S/C20H20N2O3S2/c1-24-19(23)14-18(20-26-12-5-13-27-20)22-21-15-8-10-17(11-9-15)25-16-6-3-2-4-7-16/h2-4,6-11H,5,12-14H2,1H3/b22-21+
InChIKey AYVQXPXZSMDFGH-QURGRASLSA-N
Mol Weight 400.51 g/mol
Molecular Formula C20H20N2O3S2
Exact Mass 400.091535 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3rY2pgE4WXC
Name (E)-Methyl 3-(1,3-dithian-2-ylidene)-3-((4-phenoxyphenyl)diazenyl)propanoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H20N2O3S2
InChI InChI=1S/C20H20N2O3S2/c1-24-19(23)14-18(20-26-12-5-13-27-20)22-21-15-8-10-17(11-9-15)25-16-6-3-2-4-7-16/h2-4,6-11H,5,12-14H2,1H3/b22-21+
InChIKey AYVQXPXZSMDFGH-QURGRASLSA-N
Literature Reference DOI 10.1021/ol4037133
Molecular Weight 400.511 g/mol
SMILES C(CC(=O)OC)(=C1SCCCS1)\N=N\c1ccc(cc1)Oc1ccccc1
SPLASH splash10-01b9-3900000000-ee96b94926432503c1c3
Source of Spectrum A1-16-1112/SM46-5r
Wiley ID 1749142