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Tetrahydro-8,9-dihydroxy-2,2,4-trimethyl-4,7-ethano-1,3-benzodioxol-5(4H)-one
SpectraBase Compound ID 2RLDxHv02JB
InChI InChI=1S/C12H18O5/c1-11(2)16-8-5-4-6(13)12(3,10(8)17-11)9(15)7(5)14/h5,7-10,14-15H,4H2,1-3H3/t5-,7?,8?,9?,10?,12+/m1/s1
InChIKey TYOHEMZPNQYEKF-KIZYEFCXSA-N
Mol Weight 242.27 g/mol
Molecular Formula C12H18O5
Exact Mass 242.115424 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4Mas5KJTKRL
Name Tetrahydro-8,9-dihydroxy-2,2,4-trimethyl-4,7-ethano-1,3-benzodioxol-5(4H)-one
Alternate Name(s) 10,11-dihydroxy-4,4,7-trimethyl-3,5-dioxatricyclo[5.2.2.0(2,6)]undecan-8-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H18O5
InChI InChI=1S/C12H18O5/c1-11(2)16-8-5-4-6(13)12(3,10(8)17-11)9(15)7(5)14/h5,7-10,14-15H,4H2,1-3H3/t5-,7?,8?,9?,10?,12+/m1/s1
InChIKey TYOHEMZPNQYEKF-KIZYEFCXSA-N
Molecular Weight 242.271 g/mol
SMILES OC1[C@@]2(C3OC(OC3[C@](C1O)(C(C2)=O)C)(C)C)[H]
SPLASH splash10-00di-1910000000-80340e5b28877cb66cdd
Source of Spectrum B-57-48-22
Wiley ID 1551376