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(E)-4-Hydroxy-N-isopropyl-5-phenyl-3-tosyl-hex-2-enamide
SpectraBase Compound ID 8uSLJftnY26
InChI InChI=1S/C22H27NO4S/c1-15(2)23-21(24)14-20(22(25)17(4)18-8-6-5-7-9-18)28(26,27)19-12-10-16(3)11-13-19/h5-15,17,22,25H,1-4H3,(H,23,24)/b20-14+
InChIKey KPJZRCFQVPZNEC-XSFVSMFZSA-N
Mol Weight 401.52 g/mol
Molecular Formula C22H27NO4S
Exact Mass 401.16608 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3nEq2xEGzO9
Name 2-Hexenamide, 4-hydroxy-N-(1-methylethyl)-3-[(4-methylphenyl)sulfonyl]-5-phenyl-
Alternate Name(s) (2E)-4-hydroxy-N-isopropyl-3-[(4-methylphenyl)sulfonyl]-5-phenyl-2-hexenamide (E)-4-Hydroxy-N-isopropyl-5-phenyl-3-tosylhex-2-enamide
CAS Registry Number 124455-34-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H27NO4S
InChI InChI=1S/C22H27NO4S/c1-15(2)23-21(24)14-20(22(25)17(4)18-8-6-5-7-9-18)28(26,27)19-12-10-16(3)11-13-19/h5-15,17,22,25H,1-4H3,(H,23,24)/b20-14+
InChIKey KPJZRCFQVPZNEC-XSFVSMFZSA-N
Molecular Weight 401.521 g/mol
SMILES N(C(\C=C/(C(C(c1ccccc1)C)O)S(c1ccc(cc1)C)(=O)=O)=O)C(C)C
SPLASH splash10-0002-0590000000-449dc6378e0e35ad8b14
Source of Spectrum KC-1989-1389-7
Wiley ID 1369985