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Methyl 3-((2S,4R,4aS,8S)-4-hydroxy-8-methyl-3,7-dioxooctahydro-2H-2,4a-ethanonaphthalen-8-yl)propanoate
SpectraBase Compound ID qNNreLWXRG
InChI InChI=1S/C17H24O5/c1-16(6-5-13(19)22-2)11-9-10-3-7-17(11,8-4-12(16)18)15(21)14(10)20/h10-11,15,21H,3-9H2,1-2H3/t10-,11-,15-,16+,17-/m1/s1
InChIKey RYRPOCCBFOPWES-LQIFXSKXSA-N
Mol Weight 308.37 g/mol
Molecular Formula C17H24O5
Exact Mass 308.162374 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 78vO3ZVGrui
Name Methyl 3-((2S,4R,4aS,8S)-4-hydroxy-8-methyl-3,7-dioxooctahydro-2H-2,4a-ethanonaphthalen-8-yl)propanoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H24O5
InChI InChI=1S/C17H24O5/c1-16(6-5-13(19)22-2)11-9-10-3-7-17(11,8-4-12(16)18)15(21)14(10)20/h10-11,15,21H,3-9H2,1-2H3/t10-,11-,15-,16+,17-/m1/s1
InChIKey RYRPOCCBFOPWES-LQIFXSKXSA-N
Literature Reference DOI 10.1002/asia.201403069
Molecular Weight 308.374 g/mol
SMILES O[C@@]1(C([C@@]2(CC[C@@]11[C@@]([C@](C)(CCC(OC)=O)C(=O)CC1)(C2)[H])[H])=O)[H]
SPLASH splash10-05i0-3090000000-721c33173d8591e0411a
Source of Spectrum CAJ-10-436-21
Synonyms Methyl 3-((2S,4R,4aS,8RS)-4-hydroxy-8-methyl-3,7-dioxooctahydro-2H-2,4a-ethanonaphthalen-8-yl)propanoate
Wiley ID 1785192