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2,3-O-Isopropylidene-4-O-methyl-4-epi-validatol
SpectraBase Compound ID AQpnEaraJG8
InChI InChI=1S/C11H20O4/c1-11(2)14-9-7(6-12)4-5-8(13-3)10(9)15-11/h7-10,12H,4-6H2,1-3H3/t7-,8-,9?,10?/m1/s1
InChIKey DGFSNXYAOSPUPE-LGUIWLBCSA-N
Mol Weight 216.28 g/mol
Molecular Formula C11H20O4
Exact Mass 216.136159 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8h2eqJlX3eI
Name 2,3-O-Isopropylidene-4-O-methyl-4-epi-validatol
Alternate Name(s) [(4R,7R)-7-methoxy-2,2-dimethylhexahydro-1,3-benzodioxol-4-yl]methanol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H20O4
InChI InChI=1S/C11H20O4/c1-11(2)14-9-7(6-12)4-5-8(13-3)10(9)15-11/h7-10,12H,4-6H2,1-3H3/t7-,8-,9?,10?/m1/s1
InChIKey DGFSNXYAOSPUPE-LGUIWLBCSA-N
Molecular Weight 216.277 g/mol
SMILES OC[C@@]1(C2C(OC(C)(C)O2)[C@@](CC1)(OC)[H])[H]
SPLASH splash10-056r-0900000000-977396fe1b66019cda38
Source of Spectrum J-59-6071-7
Wiley ID 1215379