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(E)-4-Hydroxy-N-isopropyl-5-methyl-3-tosyl-hex-2-enamide
SpectraBase Compound ID CiWHiuuqg6x
InChI InChI=1S/C17H25NO4S/c1-11(2)17(20)15(10-16(19)18-12(3)4)23(21,22)14-8-6-13(5)7-9-14/h6-12,17,20H,1-5H3,(H,18,19)/b15-10+
InChIKey NNMIFPOHQBWEDQ-XNTDXEJSSA-N
Mol Weight 339.45 g/mol
Molecular Formula C17H25NO4S
Exact Mass 339.150429 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9jwfoAhOpuV
Name 2-Hexenamide, 4-hydroxy-5-methyl-N-(1-methylethyl)-3-[(4-methylphenyl)sulfonyl]-, (E)-
Alternate Name(s) (2E)-4-hydroxy-N-isopropyl-5-methyl-3-[(4-methylphenyl)sulfonyl]-2-hexenamide (E)-4-Hydroxy-N-isopropyl-5-methyl-3-tosylhex-2-enamide
CAS Registry Number 124455-29-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H25NO4S
InChI InChI=1S/C17H25NO4S/c1-11(2)17(20)15(10-16(19)18-12(3)4)23(21,22)14-8-6-13(5)7-9-14/h6-12,17,20H,1-5H3,(H,18,19)/b15-10+
InChIKey NNMIFPOHQBWEDQ-XNTDXEJSSA-N
Molecular Weight 339.450 g/mol
SMILES N(C(\C=C/(C(C(C)C)O)S(c1ccc(cc1)C)(=O)=O)=O)C(C)C
SPLASH splash10-0015-4950000000-badc5a9ba3fe3bd20cb4
Source of Spectrum KC-1989-1389-7
Wiley ID 1334424