SpectraBase Compound ID | HBcWBptb0oJ |
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InChI | InChI=1S/C5H9NS/c1-5(2,3)6-4-7/h1-3H3 |
InChIKey | ZFWFRTVIIMTOLY-UHFFFAOYSA-N |
Mol Weight | 115.19 g/mol |
Molecular Formula | C5H9NS |
Exact Mass | 115.04557 g/mol |
SpectraBase Spectrum ID | 3j0qrPlpBLy |
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Name | tert-Butyl-isothiocyanate |
CAS Registry Number | 590-42-1 |
Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
Formula | C5H9NS |
InChI | InChI=1S/C5H9NS/c1-5(2,3)6-4-7/h1-3H3 |
InChIKey | ZFWFRTVIIMTOLY-UHFFFAOYSA-N |
Instrument Name | Bruker HX-90 |
Literature Reference | M. Feigel, H. Kessler, Chem. Ber. 111, 2947 (1978). |
NMR Standard | TMS |
Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |
Solvent | CDCl3 |