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4,5,8,9-TETRAHYDROCYCLOOCTA-1,2,3-SELENADIAZOL-7(6H)-ONE
SpectraBase Compound ID 4gtG9LMQaOm
InChI InChI=1S/C8H10N2OSe/c11-6-2-1-3-7-8(5-4-6)12-10-9-7/h1-5H2
InChIKey BHGDSMXMHUTFFV-UHFFFAOYSA-N
Mol Weight 229.15 g/mol
Molecular Formula C8H10N2OSe
Exact Mass 229.995835 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KEoocKDWYVx
Name 4,5,6,7,8,9-Hexahydro-1,2,3-cycloocta-selenadiazol-7-one
CAS Registry Number 67959-48-2
Comments HX-90 OR WP-80, SHIFTS PARTIALLY ASSIGNED BY T.E.
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C8H10N2OSe
InChI InChI=1S/C8H10N2OSe/c11-6-2-1-3-7-8(5-4-6)12-10-9-7/h1-5H2
InChIKey BHGDSMXMHUTFFV-UHFFFAOYSA-N
Instrument Name Bruker HX-90
Literature Reference H. Meier, J. Zountsas, O. Zimmer, Z. Naturforsch. 36B, 1017 (1981).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3