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Naphtho[2,1-b]furan-6-carboxylic acid, 3a-(1,3-dioxolan-2-yl)-3a,4,5,5a,6,7,8,9,9a,9b-decahydro-6,9a-dimethyl-, methyl ester, [3aR-(3a.alpha.,5a.beta.,6.alpha.,9a.beta.,9b.alpha.)]-
SpectraBase Compound ID 3jOClq0xsNz
InChI InChI=1S/C19H28O5/c1-17-7-4-8-18(2,15(20)21-3)13(17)5-9-19(14(17)6-10-24-19)16-22-11-12-23-16/h6,10,13-14,16H,4-5,7-9,11-12H2,1-3H3/t13-,14+,17-,18+,19-/m1/s1
InChIKey RHNNRSOSGJTOEW-SOXQQHAUSA-N
Mol Weight 336.43 g/mol
Molecular Formula C19H28O5
Exact Mass 336.193674 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6f68DP56PTD
Name Naphtho[2,1-b]furan-6-carboxylic acid, 3a-(1,3-dioxolan-2-yl)-3a,4,5,5a,6,7,8,9,9a,9b-decahydro-6,9a-dimethyl-, methyl ester, [3aR-(3a.alpha.,5a.beta.,6.alpha.,9a.beta.,9b.alpha.)]-
CAS Registry Number 118195-35-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H28O5
InChI InChI=1S/C19H28O5/c1-17-7-4-8-18(2,15(20)21-3)13(17)5-9-19(14(17)6-10-24-19)16-22-11-12-23-16/h6,10,13-14,16H,4-5,7-9,11-12H2,1-3H3/t13-,14+,17-,18+,19-/m1/s1
InChIKey RHNNRSOSGJTOEW-SOXQQHAUSA-N
Molecular Weight 336.428 g/mol
SMILES [C@]12([C@]([C@@]3(CCC[C@@]([C@@]3(CC2)[H])(C(=O)OC)C)C)(C=CO1)[H])C1OCCO1
SPLASH splash10-00di-9030000000-450a23be9616121d3627
Source of Spectrum I-66-1683-14
Synonyms (1S,5R,6R,9R,13R)-1,5-dimethyl-9-ethylenedioxymethyl-5-methoxycarbonyl-10-oxatricyclo[7.4.0.0**9,13tridec-11-ene Methyl (3aR,5aR,6S,9aR,9bS)-3a-(1,3-dioxolan-2-yl)-6,9a-dimethyl-3a,4,5,5a,6,7,8,9,9a,9b-decahydronaphtho[2,1-b]furan-6-carboxylate
Wiley ID 1332431