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2-Thia-adamantane

View entire compound with spectra: 2 NMR, and 4 MS (GC)

2-Thia-adamantane
SpectraBase Compound ID 32tNptnQCSV
InChI InChI=1S/C9H14S/c1-6-2-8-4-7(1)5-9(3-6)10-8/h6-9H,1-5H2/t6-,7+,8-,9+
InChIKey NOBCRSKNBOQNEL-SPJNRGJMSA-N
Mol Weight 154.27 g/mol
Molecular Formula C9H14S
Exact Mass 154.081622 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 437i32VlXJL
Name 2-Thia-adamantane
CAS Registry Number 281-25-4
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C9H14S
InChI InChI=1S/C9H14S/c1-6-2-8-4-7(1)5-9(3-6)10-8/h6-9H,1-5H2/t6-,7+,8-,9+
InChIKey NOBCRSKNBOQNEL-SPJNRGJMSA-N
Instrument Name Bruker WH-90
Literature Reference H. Duddeck, P. Wolff, Org. Magn. Resonance 8, 593 (1976).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3