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2,9-Bis(2-bromoethyl)-3,8-dichloronaphtho[1,2-b:8,7-b']-dithiophene
SpectraBase Compound ID 5VxIAudFIkP
InChI InChI=1S/C18H12Br2Cl2S2/c19-7-5-12-15(21)10-3-1-9-2-4-11-16(22)13(6-8-20)24-18(11)14(9)17(10)23-12/h1-4H,5-8H2
InChIKey CHQSEVCGTKHJCX-UHFFFAOYSA-N
Mol Weight 523.13 g/mol
Molecular Formula C18H12Br2Cl2S2
Exact Mass 519.812424 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3MpUsRYybuN
Name 2,9-Bis(2-bromoethyl)-3,8-dichloronaphtho[1,2-b:8,7-b']-dithiophene
Appearance Brown solid
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Exact Mass 519.812424134 u
Formula C18H12Br2Cl2S2
InChI InChI=1S/C18H12Br2Cl2S2/c19-7-5-12-15(21)10-3-1-9-2-4-11-16(22)13(6-8-20)24-18(11)14(9)17(10)23-12/h1-4H,5-8H2
InChIKey CHQSEVCGTKHJCX-UHFFFAOYSA-N
Ionization Type EI
Literature Reference DOI 10.1021/jo400205j
Molecular Weight 523.128 g/mol
SMILES C12=C(C3=C(C=C2)C=CC2=C3SC(=C2Cl)CCBr)SC(=C1Cl)CCBr
SPLASH splash10-00fr-0001690000-78cb23c6896842fdb897
Source of Spectrum JOC-78-3500-13 (DOI: 10.1021/jo400205j)
Wiley ID 1912504