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(1RS,4RS,5SR,9E)-9-Ethylidene-4-(methoxycarbonylthio)-3-methyl-7-oxobicyclo[3.3.1]non-2-ene-1-carboxylic acid methyl ester
SpectraBase Compound ID 5hcsEVNFSKz
InChI InChI=1S/C16H20O5S/c1-5-12-11-6-10(17)8-16(12,14(18)20-3)7-9(2)13(11)22-15(19)21-4/h5,7,11,13H,6,8H2,1-4H3/b12-5+/t11-,13+,16-/m1/s1
InChIKey SLYNKHLHMJNXRT-CQNMCRSDSA-N
Mol Weight 324.39 g/mol
Molecular Formula C16H20O5S
Exact Mass 324.103145 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID APtHgUFRs7z
Name (1RS,4RS,5SR,9E)-9-Ethylidene-4-(methoxycarbonylthio)-3-methyl-7-oxobicyclo[3.3.1]non-2-ene-1-carboxylic acid methyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H20O5S
InChI InChI=1S/C16H20O5S/c1-5-12-11-6-10(17)8-16(12,14(18)20-3)7-9(2)13(11)22-15(19)21-4/h5,7,11,13H,6,8H2,1-4H3/b12-5+/t11-,13+,16-/m1/s1
InChIKey SLYNKHLHMJNXRT-CQNMCRSDSA-N
Molecular Weight 324.391 g/mol
SMILES [C@@]12(\C([C@@](CC(C2)=O)([C@](C(=C1)C)(SC(=O)OC)[H])[H])=C\C)C(=O)OC
SPLASH splash10-006y-0960000000-9cf5b9fa791e76c5f04e
Source of Spectrum H1-39-113-33
Synonyms (R)-9-Eth-(E)-ylidene-4-methoxycarbonylsulfanyl-3-methyl-7-oxo-bicyclo[3.3.1]non-2-ene-1-carboxylic acid methyl ester Methyl (9E)-9-ethylidene-4-[(methoxycarbonyl)sulfanyl]-3-methyl-7-oxobicyclo[3.3.1]non-2-ene-1-carboxylate
Wiley ID 756825