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(E,3S)-2-methyl-1-(2-methyl-1,3-thiazol-4-yl)hept-1-en-5-yn-3-ol
SpectraBase Compound ID GuA1Tgu2y0H
InChI InChI=1S/C12H15NOS/c1-4-5-6-12(14)9(2)7-11-8-15-10(3)13-11/h7-8,12,14H,6H2,1-3H3/b9-7+/t12-/m0/s1
InChIKey VLGRQNILVORCLA-CRALRDPISA-N
Mol Weight 221.32 g/mol
Molecular Formula C12H15NOS
Exact Mass 221.087435 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2Z6Wu6UaNTi
Name (E,3S)-2-methyl-1-(2-methyl-1,3-thiazol-4-yl)hept-1-en-5-yn-3-ol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H15NOS
InChI InChI=1S/C12H15NOS/c1-4-5-6-12(14)9(2)7-11-8-15-10(3)13-11/h7-8,12,14H,6H2,1-3H3/b9-7+/t12-/m0/s1
InChIKey VLGRQNILVORCLA-CRALRDPISA-N
Molecular Weight 221.318 g/mol
SMILES O[C@](\C(=C\c1nc(sc1)C)C)(CC#CC)[H]
SPLASH splash10-014i-4900000000-3c4950b7e4df61472546
Source of Spectrum QE-7-5313-112
Synonyms (E,3S)-2-methyl-1-(2-methyl-4-thiazolyl)-3-hept-1-en-5-ynol (E,3S)-2-methyl-1-(2-methylthiazol-4-yl)hept-1-en-5-yn-3-ol
Wiley ID 846237