SpectraBase Compound ID | preCMZr9ek |
---|---|
InChI | InChI=1S/C25H32FNO3S/c1-2-6-22(27-30-13-4-3-7-18-9-11-21(26)12-10-18)25-23(28)15-20(16-24(25)29)19-8-5-14-31-17-19/h3,7,9-12,19-20,28H,2,4-6,8,13-17H2,1H3/b7-3+,27-22- |
InChIKey | YVHBUTKVOLXPAL-RDCCVODBSA-N |
Mol Weight | 445.6 g/mol |
Molecular Formula | C25H32FNO3S |
Exact Mass | 445.208693 g/mol |
SpectraBase Spectrum ID | 58NpjiaLiYN |
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Name | 2-Cyclohexen-1-one, 2-[1-[[[4-(4-fluorophenyl)-3-butenyl]oxy]imino]butyl]-3-hydroxy-5-(tetrahydro-2H-thiopyran-3-yl)- |
CAS Registry Number | 130057-81-7 |
Copyright | Copyright © 1989, 1990-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
Formula | C25H32FNO3S |
InChI | InChI=1S/C25H32FNO3S/c1-2-6-22(27-30-13-4-3-7-18-9-11-21(26)12-10-18)25-23(28)15-20(16-24(25)29)19-8-5-14-31-17-19/h3,7,9-12,19-20,28H,2,4-6,8,13-17H2,1H3/b7-3+,27-22- |
InChIKey | YVHBUTKVOLXPAL-RDCCVODBSA-N |
Instrument Name | Bruker IFS 85 |
Technique | Film |