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3'A,7'A-cis-3'A,4',5',6',7',7'A-Hexahydrospiro-[cyclohexan-1,1'(3'H)-isobenzofuran]-3'-one
SpectraBase Compound ID 9RODxstQkKk
InChI InChI=1S/C13H20O2/c14-12-10-6-2-3-7-11(10)13(15-12)8-4-1-5-9-13/h10-11H,1-9H2
InChIKey PVPHROVCPIPAEP-UHFFFAOYSA-N
Mol Weight 208.3 g/mol
Molecular Formula C13H20O2
Exact Mass 208.14633 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9JaQGOBcmqB
Name 3'A,7'A-trans-3'A,4',5',6',7',7'A-Hexahydrospiro-[cyclohexan-1,1'(3'H)-isobenzofuran]-3'-one
CAS Registry Number 73090-10-5
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C13H20O2
InChI InChI=1S/C13H20O2/c14-12-10-6-2-3-7-11(10)13(15-12)8-4-1-5-9-13/h10-11H,1-9H2
InChIKey PVPHROVCPIPAEP-UHFFFAOYSA-N
Instrument Name SF = 080 MHz
Literature Reference J. Org. Chem. 45, 1828 (1980).
NMR Standard not reported
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3