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1-tert-Butoxycarbonylindole-3-thiocarboxamide
SpectraBase Compound ID 545S4zXb0vw
InChI InChI=1S/C14H16N2O2S/c1-14(2,3)18-13(17)16-8-10(12(15)19)9-6-4-5-7-11(9)16/h4-8H,1-3H3,(H2,15,19)
InChIKey QHXZHHPEDYPIIP-UHFFFAOYSA-N
Mol Weight 276.35 g/mol
Molecular Formula C14H16N2O2S
Exact Mass 276.093249 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 94oLewgp3rS
Name 1-tert-Butoxycarbonylindole-3-thiocarboxamide
Appearance Yellow solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 276.093248935 u
Formula C14H16N2O2S
InChI InChI=1S/C14H16N2O2S/c1-14(2,3)18-13(17)16-8-10(12(15)19)9-6-4-5-7-11(9)16/h4-8H,1-3H3,(H2,15,19)
InChIKey QHXZHHPEDYPIIP-UHFFFAOYSA-N
Ionization Type EI
Literature Reference DOI 10.3998/ark.5550190.0001.321
Molecular Weight 276.354 g/mol
Quality 220
SMILES NC(C1=CN(C(OC(C)(C)C)=O)C2=C1C=CC=C2)=S
SPLASH splash10-000t-9000000000-de048dbf5dd0e722d554
Source of Spectrum ARK-2000-397-9 (DOI: 10.3998/ark.5550190.0001.321)
Wiley ID 1908511