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Diethyl (3R,7aR)-3-(furan-2-yl)-1,1-dimethyl-4-(prop-1-en-2-yl)-3,5,7,7a-tetrahydrocyclopenta[c]-pyran-6,6(1H)-dicarboxylate

View entire compound with spectra: 1 MS (GC)

Diethyl (3R,7aR)-3-(furan-2-yl)-1,1-dimethyl-4-(prop-1-en-2-yl)-3,5,7,7a-tetrahydrocyclopenta[c]-pyran-6,6(1H)-dicarboxylate
SpectraBase Compound ID HEazzZFdNs
InChI InChI=1S/C23H30O6/c1-7-26-20(24)23(21(25)27-8-2)12-15-16(13-23)22(5,6)29-19(18(15)14(3)4)17-10-9-11-28-17/h9-11,16,19H,3,7-8,12-13H2,1-2,4-6H3/t16-,19-/m1/s1
InChIKey PIQOXEUMOHWAJB-VQIMIIECSA-N
Mol Weight 402.49 g/mol
Molecular Formula C23H30O6
Exact Mass 402.204239 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HgGYO9Rfx1D
Name Diethyl (3R,7aR)-3-(furan-2-yl)-1,1-dimethyl-4-(prop-1-en-2-yl)-3,5,7,7a-tetrahydrocyclopenta[c]-pyran-6,6(1H)-dicarboxylate
Appearance Colourless oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H30O6
InChI InChI=1S/C23H30O6/c1-7-26-20(24)23(21(25)27-8-2)12-15-16(13-23)22(5,6)29-19(18(15)14(3)4)17-10-9-11-28-17/h9-11,16,19H,3,7-8,12-13H2,1-2,4-6H3/t16-,19-/m1/s1
InChIKey PIQOXEUMOHWAJB-VQIMIIECSA-N
Instrument Name Finnigan SSQ or 7000 Thermo Deca XP
Ionization Type EI
Literature Reference DOI 10.1002/chem.201500181
Molecular Weight 402.487 g/mol
Quality 138
Reported Formula C23H30O6
SMILES C(C)OC(=O)C1(CC=2[C@](C(O[C@@](C2C(=C)C)(C=2OC=CC2)[H])(C)C)(C1)[H])C(=O)OCC
SPLASH splash10-0fdk-0629600000-f1f61261b4e75a2b9159
Source of Spectrum QE-21-SM10-6g (DOI: 10.1002/chem.201500181)
Thin-Layer Chromatography 0.50 (Hex/EtOAc, 5:1)
Wiley ID 1906440