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(3R*,4S*)-2,5,5-Trimethyl-3-(4'-phenyl-1',2',4'-triazolidine-3',5'-dion-1'-yl)-1-hexen-4-ol
SpectraBase Compound ID LiWl6Kee0zJ
InChI InChI=1S/C17H23N3O3/c1-11(2)13(14(21)17(3,4)5)20-16(23)19(15(22)18-20)12-9-7-6-8-10-12/h6-10,13-14,21H,1H2,2-5H3,(H,18,22)/t13-,14-/m1/s1
InChIKey LMFIOFQWQZFKSZ-ZIAGYGMSSA-N
Mol Weight 317.39 g/mol
Molecular Formula C17H23N3O3
Exact Mass 317.173942 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2kSenwpX21N
Name (3R*,4S*)-2,5,5-Trimethyl-3-(4'-phenyl-1',2',4'-triazolidine-3',5'-dion-1'-yl)-1-hexen-4-ol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H23N3O3
InChI InChI=1S/C17H23N3O3/c1-11(2)13(14(21)17(3,4)5)20-16(23)19(15(22)18-20)12-9-7-6-8-10-12/h6-10,13-14,21H,1H2,2-5H3,(H,18,22)/t13-,14-/m1/s1
InChIKey LMFIOFQWQZFKSZ-ZIAGYGMSSA-N
Molecular Weight 317.389 g/mol
SMILES N1C(N(C(N1[C@@]([C@](C(C)(C)C)(O)[H])(C(=C)C)[H])=O)c1ccccc1)=O
SPLASH splash10-0159-0980000000-4cdf8a2b96c89cee744a
Source of Spectrum J-64-2199-3
Synonyms 1-{(1R)-1-[(1S)-1-hydroxy-2,2-dimethylpropyl]-2-methyl-2-propenyl}-4-phenyl-1,2,4-triazolidine-3,5-dione
Wiley ID 1529725