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cis-3-Methyl-4-{[4,7,7-trimethyl-3-oxo-2-oxabicyclo[2.2.1]hept-1-yl]carbonylthio}-4,5-dihydro-2(3H)-furanone
SpectraBase Compound ID XzRa59n7Dh
InChI InChI=1S/C15H20O5S/c1-8-9(7-19-10(8)16)21-12(18)15-6-5-14(4,11(17)20-15)13(15,2)3/h8-9H,5-7H2,1-4H3/t8-,9-,14-,15+/m1/s1
InChIKey WPCWEVHIDNRIQO-CXDKZYLESA-N
Mol Weight 312.38 g/mol
Molecular Formula C15H20O5S
Exact Mass 312.103145 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ErhVuDS5WoQ
Name cis-3-Methyl-4-{[4,7,7-trimethyl-3-oxo-2-oxabicyclo[2.2.1]hept-1-yl]carbonylthio}-4,5-dihydro-2(3H)-furanone
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Formula C15H20O5S
InChI InChI=1S/C15H20O5S/c1-8-9(7-19-10(8)16)21-12(18)15-6-5-14(4,11(17)20-15)13(15,2)3/h8-9H,5-7H2,1-4H3/t8-,9-,14-,15+/m1/s1
InChIKey WPCWEVHIDNRIQO-CXDKZYLESA-N
Molecular Weight 312.380 g/mol
SMILES [C@]12(OC(=O)[C@@](C2(C)C)(C)CC1)C(S[C@]1([C@](C(=O)OC1)(C)[H])[H])=O
SPLASH splash10-0563-9100000000-690b5c3cdcf63f6d97bc
Source of Spectrum K1-2004-1495-19
Synonyms cis-3-Methyl-4-{[(1S,4R)-4,7,7-trimethyl-3-oxo-2-oxabicyclo[2.2.1]hept-1-yl]carbonylthio}-4,5-dihydro-2(3H)-furanone S-[(3S,4S)-4-methyl-5-oxotetrahydro-3-furanyl]4,7,7-trimethyl-3-oxo-2-oxabicyclo[2.2.1]heptane-1-carbothioate
Wiley ID 1560591