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(1S,2R,5R)-5-methyl-2-(propan-2-yl)cyclohexyl (2R)-2-[6-(2,2-dimethyl-1,3-dioxolan-4-yl)-4-hydroxy-2,2-dimethyl-tetrahydro-2H-furo[3,4-d][1,3]dioxol-4-yl]propanoate

View entire compound with spectra: 1 MS (GC)

(1S,2R,5R)-5-methyl-2-(propan-2-yl)cyclohexyl (2R)-2-[6-(2,2-dimethyl-1,3-dioxolan-4-yl)-4-hydroxy-2,2-dimethyl-tetrahydro-2H-furo[3,4-d][1,3]dioxol-4-yl]propanoate
SpectraBase Compound ID EMTCG4034en
InChI InChI=1S/C25H42O8/c1-13(2)16-10-9-14(3)11-17(16)29-22(26)15(4)25(27)21-20(31-24(7,8)33-21)19(32-25)18-12-28-23(5,6)30-18/h13-21,27H,9-12H2,1-8H3/t14-,15+,16-,17+,18?,19?,20?,21?,25?/m1/s1
InChIKey MAPKLGAYTRDJNN-GLJYNNSNSA-N
Mol Weight 470.6 g/mol
Molecular Formula C25H42O8
Exact Mass 470.287968 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 22IaAogwIi
Name (1S,2R,5R)-5-methyl-2-(propan-2-yl)cyclohexyl (2R)-2-[6-(2,2-dimethyl-1,3-dioxolan-4-yl)-4-hydroxy-2,2-dimethyl-tetrahydro-2H-furo[3,4-d][1,3]dioxol-4-yl]propanoate
Alternate Name(s) [(1S,2R,5S)]-2-Methylethyl-5-methylcyclohex-1-yl](2R)-2-deoxy-2-methyl-4,5:7,8-di-O-isopropylidene-.alpha.-D-manno-oct-3-ulofuranosonate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H42O8
InChI InChI=1S/C25H42O8/c1-13(2)16-10-9-14(3)11-17(16)29-22(26)15(4)25(27)21-20(31-24(7,8)33-21)19(32-25)18-12-28-23(5,6)30-18/h13-21,27H,9-12H2,1-8H3/t14-,15+,16-,17+,18?,19?,20?,21?,25?/m1/s1
InChIKey MAPKLGAYTRDJNN-GLJYNNSNSA-N
Molecular Weight 470.603 g/mol
SMILES OC1(C2C(OC(O2)(C)C)C(O1)C1OC(C)(C)OC1)[C@](C(O[C@@]1([C@](CC[C@](C1)(C)[H])(C(C)C)[H])[H])=O)(C)[H]
SPLASH splash10-0pc3-9300100000-e6fc3bf72d5df19bc81b
Source of Spectrum F-53-12957-18
Wiley ID 803777