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(+/-)-2ALPHA-[7-METHOXYCARBONYLHEPT-4Z-ENYL]-3BETA-[3-OXO-4-(HEPTAFLUORO-1-NAPHTHYLOXY)-1E-BUTENYL]CYCLOPENTAN-1-ONE
SpectraBase Compound ID 9Llzck8aWzj
InChI InChI=1S/C28H25F7O5/c1-39-18(38)8-6-4-2-3-5-7-16-14(10-12-17(16)37)9-11-15(36)13-40-28-20-19(22(30)26(34)27(28)35)21(29)24(32)25(33)23(20)31/h2,4,9,11,14,16H,3,5-8,10,12-13H2,1H3/b4-2-,11-9+/t14-,16+/m1/s1
InChIKey IATYDUDDOLKOSC-ZTNMHSSKSA-N
Mol Weight 574.49 g/mol
Molecular Formula C28H25F7O5
Exact Mass 574.159021 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JgMptmu4Hhd
Name (+/-)-2ALPHA-[7-METHOXYCARBONYLHEPT-4Z-ENYL]-3BETA-[3-OXO-4-(HEPTAFLUORO-1-NAPHTHYLOXY)-1E-BUTENYL]CYCLOPENTAN-1-ONE
Comments #O
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Formula C28H25F7O5
InChI InChI=1S/C28H25F7O5/c1-39-18(38)8-6-4-2-3-5-7-16-14(10-12-17(16)37)9-11-15(36)13-40-28-20-19(22(30)26(34)27(28)35)21(29)24(32)25(33)23(20)31/h2,4,9,11,14,16H,3,5-8,10,12-13H2,1H3/b4-2-,11-9+/t14-,16+/m1/s1
InChIKey IATYDUDDOLKOSC-ZTNMHSSKSA-N
Instrument Name Jeol FX-90
Literature Reference G.A.TOLSTIKOV, N.G.KOMISSAROVA, F.A.AKBUTINA, M.E.ADLER, N.K.SELEZNEVA,YA.L.VEL'DER, N.S.VOSTRIKOV, V.E.PLATONOV, M.S.MIFTAKHOV (1992)Zhurn.Org.Khim.(Russ. Lang.): v.34, N4, 724-736.
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3 chloroform-d