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(3E,6X)-6-Chlorolauthisa-3,11-diene-1-yne-9,10-acetonide
SpectraBase Compound ID 1Ufr06xfFMs
InChI InChI=1S/C18H25ClO3/c1-5-7-8-9-14(19)16-12-17-15(21-18(3,4)22-17)11-10-13(6-2)20-16/h1,7-8,10-11,13-17H,6,9,12H2,2-4H3/b8-7+,11-10-/t13-,14?,15-,16+,17-/m0/s1
InChIKey RSWOZFQIXHUZTF-BDJSLYCLSA-N
Mol Weight 324.85 g/mol
Molecular Formula C18H25ClO3
Exact Mass 324.149222 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EuattekkFQH
Name (3E,6X)-6-Chlorolauthisa-3,11-diene-1-yne-9,10-acetonide
CAS Registry Number 80685-16-1
Comments broad-band decoupling (BB)
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C18H25ClO3
InChI InChI=1S/C18H25ClO3/c1-5-7-8-9-14(19)16-12-17-15(21-18(3,4)22-17)11-10-13(6-2)20-16/h1,7-8,10-11,13-17H,6,9,12H2,2-4H3/b8-7+,11-10-/t13-,14?,15-,16+,17-/m0/s1
InChIKey RSWOZFQIXHUZTF-BDJSLYCLSA-N
Instrument Name SF = 080 MHz
Literature Reference Austr. J. Chem. 34, 2393 (1981).
NMR Standard not reported
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3