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Methyl (1RS,2RS,4RS,5SR]-2-(butylthio)-4-methyl-8-oxobicyclo[3.3.0]octane-1-carboxylate
SpectraBase Compound ID 4b5nRmfrCBR
InChI InChI=1S/C15H24O3S/c1-4-5-8-19-13-9-10(2)11-6-7-12(16)15(11,13)14(17)18-3/h10-11,13H,4-9H2,1-3H3
InChIKey JZEMSPXVFOCYNZ-UHFFFAOYSA-N
Mol Weight 284.41 g/mol
Molecular Formula C15H24O3S
Exact Mass 284.144616 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DKxo9EN1ecf
Name Methyl (1RS,2RS,4RS,5SR]-2-(butylthio)-4-methyl-8-oxobicyclo[3.3.0]octane-1-carboxylate
CAS Registry Number 125278-70-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H24O3S
InChI InChI=1S/C15H24O3S/c1-4-5-8-19-13-9-10(2)11-6-7-12(16)15(11,13)14(17)18-3/h10-11,13H,4-9H2,1-3H3
InChIKey JZEMSPXVFOCYNZ-UHFFFAOYSA-N
Molecular Weight 284.414 g/mol
SMILES C12(C(CC(C2CCC1=O)C)SCCCC)C(=O)OC
SPLASH splash10-017j-0970000000-31a9a1e0ac6256725310
Source of Spectrum B-42-1470-25
Synonyms Methyl (1RS,2RS,4SR,5RS]-2-(butylthio)-4-methyl-8-oxobicyclo[3.3.0]octane-1-carboxylate Methyl (1RS,2SR,4SR,5SR]-2-(butylthio)-4-methyl-8-oxobicyclo[3.3.0]octane-1-carboxylate Methyl 3-(butylsulfanyl)-1-methyl-4-oxohexahydro-3a(1H)-pentalenecarboxylate
Wiley ID 1287765