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3'A,7'A-cis-3'A,4',7',7'A-Tetrahydrospiro-[cyclopentan-1,1'(3'H)-isobenzofuran]-3'-one
SpectraBase Compound ID LMBOblS3HaE
InChI InChI=1S/C12H16O2/c13-11-9-5-1-2-6-10(9)12(14-11)7-3-4-8-12/h1-2,9-10H,3-8H2
InChIKey BCKGMDAYEQVYFL-UHFFFAOYSA-N
Mol Weight 192.26 g/mol
Molecular Formula C12H16O2
Exact Mass 192.11503 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID K0tXOCZIQeX
Name 3'A,7'A-cis-3'A,4',7',7'A-Tetrahydrospiro-[cyclopentan-1,1'(3'H)-isobenzofuran]-3'-one
CAS Registry Number 74279-80-4
Comments broad-band decoupling (BB)
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C12H16O2
InChI InChI=1S/C12H16O2/c13-11-9-5-1-2-6-10(9)12(14-11)7-3-4-8-12/h1-2,9-10H,3-8H2
InChIKey BCKGMDAYEQVYFL-UHFFFAOYSA-N
Instrument Name SF = 080 MHz
Literature Reference J. Org. Chem. 46, 3091 (1981).
NMR Standard not reported
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3