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6-Bromo-1-tert-butoxycarbonylindole-3-thiocarboxamide
SpectraBase Compound ID HwMV82yfoQe
InChI InChI=1S/C14H15BrN2O2S/c1-14(2,3)19-13(18)17-7-10(12(16)20)9-5-4-8(15)6-11(9)17/h4-7H,1-3H3,(H2,16,20)
InChIKey WWFLVQUASANVBR-UHFFFAOYSA-N
Mol Weight 355.25 g/mol
Molecular Formula C14H15BrN2O2S
Exact Mass 354.003762 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 707QF6tgDgp
Name 6-Bromo-1-tert-butoxycarbonylindole-3-thiocarboxamide
Appearance Yellow solid
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Formula C14H15BrN2O2S
InChI InChI=1S/C14H15BrN2O2S/c1-14(2,3)19-13(18)17-7-10(12(16)20)9-5-4-8(15)6-11(9)17/h4-7H,1-3H3,(H2,16,20)
InChIKey WWFLVQUASANVBR-UHFFFAOYSA-N
Ionization Type EI
Literature Reference DOI 10.3998/ark.5550190.0001.321
Molecular Weight 355.250 g/mol
Quality 256
SMILES NC(C1=CN(C(OC(C)(C)C)=O)C2=C1C=CC(=C2)Br)=S
SPLASH splash10-0596-7859000000-aad2a246fb9564f48cba
Source of Spectrum ARK-2000-399-10 (DOI: 10.3998/ark.5550190.0001.321)
Wiley ID 1908503