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(E,3S)-3-heneicos-4-en-1-ynol
SpectraBase Compound ID Ly4zXzy6ESP
InChI InChI=1S/C21H38O/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21(22)4-2/h2,19-22H,3,5-18H2,1H3/b20-19+/t21-/m1/s1
InChIKey HVQYKJVJIUKLMD-RABMLOOZSA-N
Mol Weight 306.5 g/mol
Molecular Formula C21H38O
Exact Mass 306.292266 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B8NWgvl6pCs
Name (E,3S)-3-heneicos-4-en-1-ynol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H38O
InChI InChI=1S/C21H38O/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21(22)4-2/h2,19-22H,3,5-18H2,1H3/b20-19+/t21-/m1/s1
InChIKey HVQYKJVJIUKLMD-RABMLOOZSA-N
Molecular Weight 306.534 g/mol
SMILES O[C@@](\C=C\CCCCCCCCCCCCCCCC)(C#C)[H]
SPLASH splash10-0007-9300000000-0619794f214f549df7c7
Source of Spectrum G4-58-1806-7
Synonyms (E,3S)-heneicos-4-en-1-yn-3-ol (E,3S)-henicos-4-en-1-yn-3-ol
Wiley ID 1606093