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(3a'R,6a'S)-4'-[4-(Benzyloxy)butyl]-3',3a',4',6a'-tetrahydro-2'H-spiro[1,3-dioxolane-2,1'-pentalen]-4'-ol
SpectraBase Compound ID EgArl0VkToB
InChI InChI=1S/C21H28O4/c22-20(10-4-5-13-23-16-17-6-2-1-3-7-17)11-8-19-18(20)9-12-21(19)24-14-15-25-21/h1-3,6-8,11,18-19,22H,4-5,9-10,12-16H2/t18-,19+,20?/m1/s1
InChIKey DJKOSABFWWYASR-LFPSWIHMSA-N
Mol Weight 344.45 g/mol
Molecular Formula C21H28O4
Exact Mass 344.198759 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID G9mhtaG1wPF
Name (3a'R,6a'S)-4'-[4-(Benzyloxy)butyl]-3',3a',4',6a'-tetrahydro-2'H-spiro[1,3-dioxolane-2,1'-pentalen]-4'-ol
Alternate Name(s) 4'-[4-(Benzyloxy)butyl]-3',3a',4',6a'-tetrahydro-2'H-spiro[1,3-dioxolane-2,1'-pentalen]-4'-ol (3a'R,6a'S)-4'-(4-(benzyloxy)butyl)-3',3a',4',6a'-tetrahydro-2'H-spiro[[1,3]dioxolane-2,1'-pentalen]-4'-ol
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Formula C21H28O4
InChI InChI=1S/C21H28O4/c22-20(10-4-5-13-23-16-17-6-2-1-3-7-17)11-8-19-18(20)9-12-21(19)24-14-15-25-21/h1-3,6-8,11,18-19,22H,4-5,9-10,12-16H2/t18-,19+,20?/m1/s1
InChIKey DJKOSABFWWYASR-LFPSWIHMSA-N
Molecular Weight 344.451 g/mol
SMILES OC1([C@]2([C@@](C3(OCCO3)CC2)(C=C1)[H])[H])CCCCOCc1ccccc1
SPLASH splash10-0005-9410000000-5de06748d608876cc571
Source of Spectrum F-69-7378-26
Wiley ID 1738301