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7-(4-CARBOXY-1(Z)-BUTYLIDENE)-3ALPHA-METHYL-2BETA-(3ALPHA-HYDROXY-1(E)-OCTENYL)BICYCLO[3.3.0]OCTANE
SpectraBase Compound ID 81oaEBKnay9
InChI InChI=1S/C22H36O3/c1-3-4-5-9-19(23)11-12-20-16(2)13-18-14-17(15-21(18)20)8-6-7-10-22(24)25/h8,11-12,16,18-21,23H,3-7,9-10,13-15H2,1-2H3,(H,24,25)/b12-11+,17-8-/t16-,18-,19+,20+,21+/m0/s1
InChIKey DXMILQCOSMETFU-POJHXJBUSA-N
Mol Weight 348.5 g/mol
Molecular Formula C22H36O3
Exact Mass 348.266445 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID InAHDVoANzV
Name 7-(4-CARBOXY-1(Z)-BUTYLIDENE)-3ALPHA-METHYL-2BETA-(3ALPHA-HYDROXY-1(E)-OCTENYL)BICYCLO[3.3.0]OCTANE
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C22H36O3
InChI InChI=1S/C22H36O3/c1-3-4-5-9-19(23)11-12-20-16(2)13-18-14-17(15-21(18)20)8-6-7-10-22(24)25/h8,11-12,16,18-21,23H,3-7,9-10,13-15H2,1-2H3,(H,24,25)/b12-11+,17-8-/t16-,18-,19+,20+,21+/m0/s1
InChIKey DXMILQCOSMETFU-POJHXJBUSA-N
Instrument Name Bruker AM-300
Literature Reference G.A.TOLSTIKOV, R.R.AKHMETVALEEV, L.M.KHALILOV, M.S.MIFTAKHOV (1991)Zhurn.Org.Khim.(Russ. Lang.): v.27, N11, 2327-2333.
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3 chloroform-d