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7-Acetyloxymethylene-5-.alpha.(-methylthio)acetyl-3-methyl-2-oxabicyclo[4.3.0]nona-3,8-diene
SpectraBase Compound ID IF0IcF5Lh1a
InChI InChI=1S/C14H16O4S/c1-8-6-11(14(16)19-3)13-10(7-17-9(2)15)4-5-12(13)18-8/h4-7,11-13H,1-3H3/b10-7-/t11-,12?,13?/m1/s1
InChIKey OEWJICNPYKEUQA-CDWPTEPISA-N
Mol Weight 280.34 g/mol
Molecular Formula C14H16O4S
Exact Mass 280.07693 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2LO64k2Dmw5
Name 7-Acetyloxymethylene-5-.alpha.(-methylthio)acetyl-3-methyl-2-oxabicyclo[4.3.0]nona-3,8-diene
Alternate Name(s) (Z)-((4S)-2-methyl-4-[(methylsulfanyl)carbonyl]-4a,7a-dihydrocyclopenta[b]pyran-5(4H)-ylidene)methyl acetate 7-Acetyloxymethylene-5-.alpha.(-methylthio)acetyl-3-methyl-2-oxacyclo[4.3.0]nona-3,8-diene
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H16O4S
InChI InChI=1S/C14H16O4S/c1-8-6-11(14(16)19-3)13-10(7-17-9(2)15)4-5-12(13)18-8/h4-7,11-13H,1-3H3/b10-7-/t11-,12?,13?/m1/s1
InChIKey OEWJICNPYKEUQA-CDWPTEPISA-N
Molecular Weight 280.338 g/mol
SMILES [C@]1(C2C(C=C\C2=C/OC(=O)C)OC(=C1)C)(C(=O)SC)[H]
SPLASH splash10-001i-0090000000-49cacf16171b2468fa21
Source of Spectrum F-53-17661-13
Wiley ID 805029