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Dimethyl (1'R*,2'R*,2''R*,3'R*)-[2'-(2'',3''-epoxypropyl)-3'-methoxymethyloxy-2'-methylcyclohexyl]malonate
SpectraBase Compound ID AywUnb46Qlt
InChI InChI=1S/C17H28O7/c1-17(8-11-9-23-11)12(6-5-7-13(17)24-10-20-2)14(15(18)21-3)16(19)22-4/h11-14H,5-10H2,1-4H3/t11-,12-,13-,17-/m1/s1
InChIKey GXCIIBAPZVIWQV-HPTBWKMGSA-N
Mol Weight 344.4 g/mol
Molecular Formula C17H28O7
Exact Mass 344.183503 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID kPujECJJTl
Name Dimethyl (1'R*,2'R*,2''R*,3'R*)-[2'-(2'',3''-epoxypropyl)-3'-methoxymethyloxy-2'-methylcyclohexyl]malonate
Alternate Name(s) Dimethyl (1'R*,2'R*,2''R*,3'R*)-[2'-(2'',3''-epoxypropyl)-3'-methoxymethyloxy-2'-methylcyclohexyl]malonate Dimethyl 2-{(1R,2R,3R)-3-(methoxymethoxy)-2-methyl-2-[(2R)-oxiranylmethyl]cyclohexyl}malonate 2-[(1R,2R,3R)-3-(methoxymethoxy)-2-methyl-2-[[(2R)-2-oxiranyl]methyl]cyclohexyl]propanedioic acid dimethyl ester Dimethyl 2-[(1R,2R,3R)-3-(methoxymethoxy)-2-methyl-2-[[(2R)-oxiran-2-yl]methyl]cyclohexyl]propanedioate
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Formula C17H28O7
InChI InChI=1S/C17H28O7/c1-17(8-11-9-23-11)12(6-5-7-13(17)24-10-20-2)14(15(18)21-3)16(19)22-4/h11-14H,5-10H2,1-4H3/t11-,12-,13-,17-/m1/s1
InChIKey GXCIIBAPZVIWQV-HPTBWKMGSA-N
Molecular Weight 344.404 g/mol
SMILES [C@@]1([C@@](C(C(=O)OC)C(=O)OC)(CCC[C@]1(OCOC)[H])[H])(C[C@]1(OC1)[H])C
SPLASH splash10-001i-2920000000-ced892f5b980771cc1a0
Source of Spectrum B-48-609-0
Wiley ID 1337772