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(5S,4R)-(S)-tert-Butyl 2-[1-methoxy-2-(2,2,4-trimethyl-1,3-dioxolan-5-yl)-2-(p-methoxybenzoxy)ethyl]cyclopropane-1-carboxylate
SpectraBase Compound ID BMCCQDhnD53
InChI InChI=1S/C25H38O7/c1-15-20(31-25(5,6)30-15)22(29-14-16-9-11-17(27-7)12-10-16)21(28-8)18-13-19(18)23(26)32-24(2,3)4/h9-12,15,18-22H,13-14H2,1-8H3/t15-,18?,19?,20+,21+,22+/m1/s1
InChIKey MBPJFIZMQXMMJS-MHLYIGBOSA-N
Mol Weight 450.6 g/mol
Molecular Formula C25H38O7
Exact Mass 450.261754 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KfjIcMTKbnF
Name (5S,4R)-(S)-tert-Butyl 2-[1-methoxy-2-(2,2,4-trimethyl-1,3-dioxolan-5-yl)-2-(p-methoxybenzoxy)ethyl]cyclopropane-1-carboxylate
Alternate Name(s) (1S)-1-C-[2-(tert-butoxycarbonyl)cyclopropyl]-5-deoxy-2-O-(4-methoxybenzyl)-1-O-methyl-3,4-O-(1-methylethylidene)-D-threo-pentitol tert-Butyl 2-[1-methoxy-2-[(2,2,4-trimethyl-1,3-dioxolan-5-yl)-2-(p-methoxybenzoxy)ethyl]cyclopropane-1-carboxylate
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Formula C25H38O7
InChI InChI=1S/C25H38O7/c1-15-20(31-25(5,6)30-15)22(29-14-16-9-11-17(27-7)12-10-16)21(28-8)18-13-19(18)23(26)32-24(2,3)4/h9-12,15,18-22H,13-14H2,1-8H3/t15-,18?,19?,20+,21+,22+/m1/s1
InChIKey MBPJFIZMQXMMJS-MHLYIGBOSA-N
Molecular Weight 450.572 g/mol
SMILES C1(C(C(OC(C)(C)C)=O)C1)[C@@]([C@]([C@]1(OC(C)(C)O[C@@]1(C)[H])[H])(OCc1ccc(cc1)OC)[H])(OC)[H]
SPLASH splash10-000i-0947200000-04406087ada5a6184584
Source of Spectrum F-55-1619-23
Wiley ID 836781