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ISOTHIOCYANIC ACID, 1-BROMO-1-METHYLETHYL ESTER
SpectraBase Compound ID HDYresAHCTE
InChI InChI=1S/C4H6BrNS/c1-4(2,5)6-3-7/h1-2H3
InChIKey UQQFPSMJCSODQZ-UHFFFAOYSA-N
Mol Weight 180.06 g/mol
Molecular Formula C4H6BrNS
Exact Mass 178.940433 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3cxJYrg8JQK
Name (.alpha.-Bromoisopropyl)-isothiocyanate
CAS Registry Number 71055-94-2
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C4H6BrNS
InChI InChI=1S/C4H6BrNS/c1-4(2,5)6-3-7/h1-2H3
InChIKey UQQFPSMJCSODQZ-UHFFFAOYSA-N
Instrument Name Bruker HX-90
Literature Reference A.Q. Hussein, J.C. Jochims, Chem. Ber. 112, 1948 (1979).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3