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(1R,4S,5R,6S)-6-[(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]-2-keto-4-(methoxymethoxy)-1-methyl-bicyclo[2.2.2]octane-5-carboxylic acid methyl ester

View entire compound with spectra: 1 MS (GC)

(1R,4S,5R,6S)-6-[(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]-2-keto-4-(methoxymethoxy)-1-methyl-bicyclo[2.2.2]octane-5-carboxylic acid methyl ester
SpectraBase Compound ID IUCvJyv7ziZ
InChI InChI=1S/C18H28O7/c1-16(2)23-9-11(25-16)13-14(15(20)22-5)18(24-10-21-4)7-6-17(13,3)12(19)8-18/h11,13-14H,6-10H2,1-5H3/t11-,13+,14+,17+,18+/m1/s1
InChIKey OQTAXRPGCQERNC-MQTICVDDSA-N
Mol Weight 356.42 g/mol
Molecular Formula C18H28O7
Exact Mass 356.183503 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FvQPRNaO7RX
Name (1R,4S,5R,6S)-6-[(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]-2-keto-4-(methoxymethoxy)-1-methyl-bicyclo[2.2.2]octane-5-carboxylic acid methyl ester
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Formula C18H28O7
InChI InChI=1S/C18H28O7/c1-16(2)23-9-11(25-16)13-14(15(20)22-5)18(24-10-21-4)7-6-17(13,3)12(19)8-18/h11,13-14H,6-10H2,1-5H3/t11-,13+,14+,17+,18+/m1/s1
InChIKey OQTAXRPGCQERNC-MQTICVDDSA-N
Molecular Weight 356.415 g/mol
SMILES [C@]12([C@@]([C@@]([C@@]3(OC(C)(C)OC3)[H])([H])[C@](CC1)(C)C(C2)=O)(C(=O)OC)[H])OCOC
SPLASH splash10-0006-0049000000-aae8e63514b39b809b29
Source of Spectrum F-50-672-10
Synonyms (1R,4S,5R,6S)-6-[(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]-4-(methoxymethoxy)-1-methyl-2-oxo-5-bicyclo[2.2.2]octanecarboxylic acid methyl ester Methyl (1R,4S,5R,6S)-6-[(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]-4-(methoxymethoxy)-1-methyl-2-oxidanylidene-bicyclo[2.2.2]octane-5-carboxylate Methyl (1R,4S,5R,6S)-6-[(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]-4-(methoxymethoxy)-1-methyl-2-oxo-bicyclo[2.2.2]octane-5-carboxylate
Wiley ID 1345687