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1-[5,6-Dihydro-2,5-dimethyl-6-(4'-methoxyphenyl)-1,4-oxathiin-3-yl]ethanone
SpectraBase Compound ID 9nk6d2IoJ30
InChI InChI=1S/C15H18O3S/c1-9(16)15-10(2)18-14(11(3)19-15)12-5-7-13(17-4)8-6-12/h5-8,11,14H,1-4H3/t11-,14+/m0/s1
InChIKey PPJYJMNJUFSKSK-SMDDNHRTSA-N
Mol Weight 278.37 g/mol
Molecular Formula C15H18O3S
Exact Mass 278.097666 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1RnvG0UiBYV
Name 1-[5,6-Dihydro-2,5-dimethyl-6-(4'-methoxyphenyl)-1,4-oxathiin-3-yl]ethanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H18O3S
InChI InChI=1S/C15H18O3S/c1-9(16)15-10(2)18-14(11(3)19-15)12-5-7-13(17-4)8-6-12/h5-8,11,14H,1-4H3/t11-,14+/m0/s1
InChIKey PPJYJMNJUFSKSK-SMDDNHRTSA-N
Molecular Weight 278.366 g/mol
SMILES C=1(S[C@@](C)([C@@](OC1C)(c1ccc(cc1)OC)[H])[H])C(=O)C
SPLASH splash10-0032-3900000000-17af0d517752da1c50f1
Source of Spectrum J-60-6424-20
Synonyms 1-[(5S,6S)-6-(4-Methoxy-phenyl)-2,5-dimethyl-5,6-dihydro-[1,4]oxathiin-3-yl]-ethanone 1-[5,6-dihydro-2,7-dimethyl-6-(4'-methoxyphenyl)-1,4-oxathiin-3-yl]ethanone 1-[6-(4-methoxyphenyl)-2,5-dimethyl-5,6-dihydro-1,4-oxathiin-3-yl]ethanone
Wiley ID 1281854