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(1RS,2SR)-1,8,8-trimethyl-1-(2'-oxoethyl)-6,10-dioxaspiro[4.5]dec-2-yl benzoate
SpectraBase Compound ID GjpHDD7AgUp
InChI InChI=1S/C20H26O5/c1-18(2)13-23-20(24-14-18)10-9-16(19(20,3)11-12-21)25-17(22)15-7-5-4-6-8-15/h4-8,12,16H,9-11,13-14H2,1-3H3/t16-,19-/m1/s1
InChIKey XIUDHIMBWHWSLY-VQIMIIECSA-N
Mol Weight 346.42 g/mol
Molecular Formula C20H26O5
Exact Mass 346.178024 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DDetHY94V5U
Name (1RS,2RS)-1,8,8-trimethyl-1-(2'-oxoethyl)-6,10-dioxaspiro[4.5]dec-2-yl benzoate
Alternate Name(s) (1RS,2SR)-1,8,8-trimethyl-1-(2'-oxoethyl)-6,10-dioxaspiro[4.5]dec-2-yl benzoate 1,8,8-trimethyl-1-(2-oxoethyl)-6,10-dioxaspiro[4.5]dec-2-yl benzoate Benzoic acid (1R,2R)-1,8,8-trimethyl-1-(2-oxo-ethyl)-6,10-dioxa-spiro[4.5]dec-2-yl ester
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Formula C20H26O5
InChI InChI=1S/C20H26O5/c1-18(2)13-23-20(24-14-18)10-9-16(19(20,3)11-12-21)25-17(22)15-7-5-4-6-8-15/h4-8,12,16H,9-11,13-14H2,1-3H3/t16-,19-/m1/s1
InChIKey XIUDHIMBWHWSLY-VQIMIIECSA-N
Molecular Weight 346.423 g/mol
SMILES [C@]1(C2(OCC(CO2)(C)C)CC[C@]1(OC(=O)c1ccccc1)[H])(CC=O)C
SPLASH splash10-05r0-9710000000-e388b6dd4be4bf120abf
Source of Spectrum B-47-739-0
Wiley ID 1339395