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2-Cyclohexen-1-one, 2-[1-[[[4-[4-(1,1-dimethylethyl)phenyl]-2-butenyl]oxy]imino]propyl]-3-hydroxy-5-(tetrahydro-2H-thiopyran-3-yl)-; 2H-thiopyran, 2-cyclohexen-1-one derivative

View entire compound with spectra: 1 NMR, and 1 FTIR

2-Cyclohexen-1-one, 2-[1-[[[4-[4-(1,1-dimethylethyl)phenyl]-2-butenyl]oxy]imino]propyl]-3-hydroxy-5-(tetrahydro-2H-thiopyran-3-yl)-; 2H-thiopyran, 2-cyclohexen-1-one derivative
SpectraBase Compound ID KitDNfsKVGg
InChI InChI=1S/C28H39NO3S/c1-5-24(27-25(30)17-22(18-26(27)31)21-10-8-16-33-19-21)29-32-15-7-6-9-20-11-13-23(14-12-20)28(2,3)4/h6-7,11-14,21-22,30H,5,8-10,15-19H2,1-4H3/b7-6+,29-24+
InChIKey HUYOJMQEEZXKJK-MJSMXXMUSA-N
Mol Weight 469.7 g/mol
Molecular Formula C28H39NO3S
Exact Mass 469.265065 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID ChT5ICTfDho
Name 2-Cyclohexen-1-one, 2-[1-[[[4-[4-(1,1-dimethylethyl)phenyl]-2-butenyl]oxy]imino]propyl]-3-hydroxy-5-(tetrahydro-2H-thiopyran-3-yl)-
CAS Registry Number 130057-17-9
Copyright Copyright © 1989, 1990-2025 Wiley-VCH GmbH. All Rights Reserved.
Formula C28H39NO3S
InChI InChI=1S/C28H39NO3S/c1-5-24(27-25(30)17-22(18-26(27)31)21-10-8-16-33-19-21)29-32-15-7-6-9-20-11-13-23(14-12-20)28(2,3)4/h6-7,11-14,21-22,30H,5,8-10,15-19H2,1-4H3/b7-6+,29-24+
InChIKey HUYOJMQEEZXKJK-MJSMXXMUSA-N
Instrument Name Bruker IFS 85
Synonyms 2H-Thiopyran, 2-cyclohexen-1-one derivative
Technique Film