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7-(4-CARBOXYBUTYLIDENE)-2-(3-HYDROXY-1E-OCTENYL)BICYCLO[3.3.0]OCT-2-ENE (ISOMER 1)
SpectraBase Compound ID ACnRBROpTTv
InChI InChI=1S/C21H32O3/c1-2-3-4-8-19(22)13-12-17-10-11-18-14-16(15-20(17)18)7-5-6-9-21(23)24/h7,10,12-13,18-20,22H,2-6,8-9,11,14-15H2,1H3,(H,23,24)/b13-12+,16-7-/t18-,19+,20-/m0/s1
InChIKey RWXHLEARGYHNDS-OWEMHJAESA-N
Mol Weight 332.5 g/mol
Molecular Formula C21H32O3
Exact Mass 332.235145 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 98kzIKzwEV9
Name 7-(4-CARBOXYBUTYLIDENE)-2-(3-HYDROXY-1E-OCTENYL)BICYCLO[3.3.0]OCT-2-ENE (ISOMER 1)
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Formula C21H32O3
InChI InChI=1S/C21H32O3/c1-2-3-4-8-19(22)13-12-17-10-11-18-14-16(15-20(17)18)7-5-6-9-21(23)24/h7,10,12-13,18-20,22H,2-6,8-9,11,14-15H2,1H3,(H,23,24)/b13-12+,16-7-/t18-,19+,20-/m0/s1
InChIKey RWXHLEARGYHNDS-OWEMHJAESA-N
Instrument Name Jeol FX-90
Literature Reference G.A.TOLSTIKOV, M.S.MIFTAKHOV, R.R.AKHMETVALEEV, F.A.VALEEV, L.M.KHALILOV,E.V.VASIL'EVA (1991) Zhurn.Org.Khim.(Russ. Lang.): v.27, N5, 977-984.
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3 chloroform-d