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(1S,2S,3S,4S)-3,4-O-Isopropyliderne-2-methylcyclohex-5-en-1,2,3,4-tetraol
SpectraBase Compound ID IH43moa4wN4
InChI InChI=1S/C10H16O4/c1-9(2)13-6-4-5-7(11)10(3,12)8(6)14-9/h4-8,11-12H,1-3H3/t6-,7-,8-,10-/m0/s1
InChIKey WSEWXVNJRUZZNN-GHCJXIJMSA-N
Mol Weight 200.23 g/mol
Molecular Formula C10H16O4
Exact Mass 200.104859 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID K621tCWqdTD
Name (1S,2S,3S,4S)-3,4-O-Isopropyliderne-2-methylcyclohex-5-en-1,2,3,4-tetraol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H16O4
InChI InChI=1S/C10H16O4/c1-9(2)13-6-4-5-7(11)10(3,12)8(6)14-9/h4-8,11-12H,1-3H3/t6-,7-,8-,10-/m0/s1
InChIKey WSEWXVNJRUZZNN-GHCJXIJMSA-N
Molecular Weight 200.234 g/mol
SMILES O[C@]1(C=C[C@@]2(OC(O[C@@]2([C@]1(O)C)[H])(C)C)[H])[H]
SPLASH splash10-0udl-5900000000-71b398b9279a48774a50
Source of Spectrum C3-23-553-4
Synonyms (3aS,4S,5S,7aS)-2,2,4-Trimethyl-3a,4,5,7a-tetrahydro-benzo[1,3]dioxole-4,5-diol (3aS,4s,5s,7aS)-2,2,4-Trimethyl-3a,4,5,7a-tetrahydro-1,3-benzodioxole-4,5-diol (3aS,4S,5S,7aS)-2,2,4-trimethyl-3a,4,5,7a-tetrahydrobenzo[d][1,3]dioxole-4,5-diol
Wiley ID 879727