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9-.alpha.-Methanesulfonyloxy-5-methyltricyclo[6.3.0.0(1,5)]undeca-4,7-dione
SpectraBase Compound ID AVAdbWDvKDY
InChI InChI=1S/C13H18O5S/c1-12-7-8(14)11-9(18-19(2,16)17)3-5-13(11,12)6-4-10(12)15/h9,11H,3-7H2,1-2H3/t9-,11?,12?,13?/m1/s1
InChIKey YXUHFWHXYNSZBU-HNLWRCSVSA-N
Mol Weight 286.34 g/mol
Molecular Formula C13H18O5S
Exact Mass 286.087495 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1pQwr4S4rau
Name 9-.alpha.-Methanesulfonyloxy-5-methyltricyclo[6.3.0.0(1,5)]undeca-4,7-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H18O5S
InChI InChI=1S/C13H18O5S/c1-12-7-8(14)11-9(18-19(2,16)17)3-5-13(11,12)6-4-10(12)15/h9,11H,3-7H2,1-2H3/t9-,11?,12?,13?/m1/s1
InChIKey YXUHFWHXYNSZBU-HNLWRCSVSA-N
Molecular Weight 286.342 g/mol
SMILES C123C(CC(C3[C@](OS(=O)(=O)C)(CC1)[H])=O)(C(=O)CC2)C
SPLASH splash10-000x-9100000000-f997632f4b98f44ea4ba
Source of Spectrum QB-12-395-13
Synonyms (3R)-5a-methyl-4,6-dioxodecahydrocyclopenta[c]pentalen-3-yl methanesulfonate Methanesulfonic acid (R)-5a-methyl-4,6-dioxo-decahydro-cyclopenta[c]pentalen-3-yl ester
Wiley ID 840953