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1-Methyl-5-ethyl-5-[4'-(phenylthio)phenyl]-6-hydroxy(perhydro)pyrano[3,2-d]oxazole-2-one
SpectraBase Compound ID Iudh9XuVjZ6
InChI InChI=1S/C21H23NO4S/c1-3-21(18(23)13-17-19(26-21)25-20(24)22(17)2)14-9-11-16(12-10-14)27-15-7-5-4-6-8-15/h4-12,17-19,23H,3,13H2,1-2H3
InChIKey HVQUZAKDUPKOPW-UHFFFAOYSA-N
Mol Weight 385.48 g/mol
Molecular Formula C21H23NO4S
Exact Mass 385.134779 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID G37EBDrS0tP
Name 1-Methyl-5-ethyl-5-[4'-(phenylthio)phenyl]-6-hydroxy(perhydro)pyrano[3,2-d]oxazole-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H23NO4S
InChI InChI=1S/C21H23NO4S/c1-3-21(18(23)13-17-19(26-21)25-20(24)22(17)2)14-9-11-16(12-10-14)27-15-7-5-4-6-8-15/h4-12,17-19,23H,3,13H2,1-2H3
InChIKey HVQUZAKDUPKOPW-UHFFFAOYSA-N
Molecular Weight 385.478 g/mol
SMILES OC1CC2N(C(OC2OC1(c1ccc(Sc2ccccc2)cc1)CC)=O)C
SPLASH splash10-01t9-2290000000-5e5a24bbe89f68da8691
Source of Spectrum Y-32-580-14
Synonyms 5-Ethyl-6-hydroxy-1-methyl-5-[4-(phenylsulfanyl)phenyl]tetrahydro-3aH-pyrano[3,2-d][1,3]oxazol-2(1H)-one
Wiley ID 1362206