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trans-5-(N-Allyl-N-tosylamino)-6-methyl-4-(phenylthio)-5,6-dihydropyran-2-one
SpectraBase Compound ID 74owRlrr5wF
InChI InChI=1S/C22H23NO4S2/c1-4-14-23(29(25,26)19-12-10-16(2)11-13-19)22-17(3)27-21(24)15-20(22)28-18-8-6-5-7-9-18/h4-13,15,17,22H,1,14H2,2-3H3/t17-,22-/m0/s1
InChIKey FBTQOABSKSKXNV-JTSKRJEESA-N
Mol Weight 429.55 g/mol
Molecular Formula C22H23NO4S2
Exact Mass 429.106851 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID v3ess2FpWo
Name trans-5-(N-Allyl-N-tosylamino)-6-methyl-4-(phenylthio)-5,6-dihydropyran-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H23NO4S2
InChI InChI=1S/C22H23NO4S2/c1-4-14-23(29(25,26)19-12-10-16(2)11-13-19)22-17(3)27-21(24)15-20(22)28-18-8-6-5-7-9-18/h4-13,15,17,22H,1,14H2,2-3H3/t17-,22-/m0/s1
InChIKey FBTQOABSKSKXNV-JTSKRJEESA-N
Molecular Weight 429.549 g/mol
SMILES [C@]1(N(S(c2ccc(cc2)C)(=O)=O)CC=C)(C(=CC(O[C@]1(C)[H])=O)Sc1ccccc1)[H]
SPLASH splash10-001i-5091000000-7380769d170229084183
Source of Spectrum F-70-1853-12
Synonyms N-allyl-4-methyl-N-((2S,3S)-2-methyl-6-oxo-4-(phenylthio)-3,6-dihydro-2H-pyran-3-yl)benzenesulfonamide
Wiley ID 1742675