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Methyl (4aS*,5S*,8aR*)-5-acetoxy-1,1,3-trimethoxy-2-oxo-1,2,4a,5,8,8a-hexahydro-4a-naphthalenecarboxylate
SpectraBase Compound ID 26dpf0ITC9T
InChI InChI=1S/C17H22O8/c1-10(18)25-13-8-6-7-12-16(13,15(20)22-3)9-11(21-2)14(19)17(12,23-4)24-5/h6,8-9,12-13H,7H2,1-5H3/t12-,13+,16+/m1/s1
InChIKey PTNBWOJIGCZMGI-WWGRRREGSA-N
Mol Weight 354.36 g/mol
Molecular Formula C17H22O8
Exact Mass 354.131468 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EJCGVnGs785
Name Methyl (4aS*,5S*,8aR*)-5-acetoxy-1,1,3-trimethoxy-2-oxo-1,2,4a,5,8,8a-hexahydro-4a-naphthalenecarboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H22O8
InChI InChI=1S/C17H22O8/c1-10(18)25-13-8-6-7-12-16(13,15(20)22-3)9-11(21-2)14(19)17(12,23-4)24-5/h6,8-9,12-13H,7H2,1-5H3/t12-,13+,16+/m1/s1
InChIKey PTNBWOJIGCZMGI-WWGRRREGSA-N
Molecular Weight 354.355 g/mol
SMILES [C@]12([C@](C(OC)(OC)C(C(=C2)OC)=O)(CC=C[C@@]1(OC(=O)C)[H])[H])C(=O)OC
SPLASH splash10-00dl-3194000000-e165e39c092981429d8c
Source of Spectrum F-69-5372-15
Synonyms Methyl (4aS,5S,8aR)-5-(acetyloxy)-1,1,3-trimethoxy-2-oxo-1,5,8,8a-tetrahydro-4a(2H)-naphthalenecarboxylate (4S,4aS,8aR)-4-acetyloxy-6,8,8-trimethoxy-7-oxo-4,8a-dihydro-1H-naphthalene-4a-carboxylic acid methyl ester Methyl (4S,4aS,8aR)-4-acetyloxy-6,8,8-trimethoxy-7-oxo-4,8a-dihydro-1H-naphthalene-4a-carboxylate Methyl (4S,4aS,8aR)-4-acetoxy-6,8,8-trimethoxy-7-oxo-4,8a-dihydro-1H-naphthalene-4a-carboxylate Methyl (4S,4aS,8aR)-4-acetyloxy-6,8,8-trimethoxy-7-oxidanylidene-4,8a-dihydro-1H-naphthalene-4a-carboxylate
Wiley ID 1595418