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S-Methyl trans-2-(3,4-Dihydro-6-methoxy-2-naphthyl)-1-methyl-5-oxocyclopentane-r-1-thiocarboxylate
SpectraBase Compound ID 8EVAgTyDpLn
InChI InChI=1S/C19H22O3S/c1-19(18(21)23-3)16(8-9-17(19)20)14-5-4-13-11-15(22-2)7-6-12(13)10-14/h6-7,10-11,16H,4-5,8-9H2,1-3H3/t16-,19-/m1/s1
InChIKey UTNCNJYXTQEDTJ-VQIMIIECSA-N
Mol Weight 330.44 g/mol
Molecular Formula C19H22O3S
Exact Mass 330.128966 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ALQYkwF9g91
Name S-Methyl trans-2-(3,4-Dihydro-6-methoxy-2-naphthyl)-1-methyl-5-oxocyclopentane-r-1-thiocarboxylate
CAS Registry Number 139378-36-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H22O3S
InChI InChI=1S/C19H22O3S/c1-19(18(21)23-3)16(8-9-17(19)20)14-5-4-13-11-15(22-2)7-6-12(13)10-14/h6-7,10-11,16H,4-5,8-9H2,1-3H3/t16-,19-/m1/s1
InChIKey UTNCNJYXTQEDTJ-VQIMIIECSA-N
Molecular Weight 330.442 g/mol
SMILES [C@@]1([C@@](C2=Cc3ccc(cc3CC2)OC)(CCC1=O)[H])(C(=O)SC)C
SPLASH splash10-0a59-0092000000-68e1ca0aad44c42c1d53
Source of Spectrum J-57-2262-25
Synonyms S-methyl (1R,2R)-2-(6-methoxy-3,4-dihydro-2-naphthalenyl)-1-methyl-5-oxocyclopentanecarbothioate
Wiley ID 1327909