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3-Heptyne-2,5-diol, 6-methyl-5-(1-methylethyl)-
SpectraBase Compound ID DRpX7nXPfqA
InChI InChI=1S/C11H20O2/c1-8(2)11(13,9(3)4)7-6-10(5)12/h8-10,12-13H,1-5H3
InChIKey VWLKPPQKBIODPH-UHFFFAOYSA-N
Mol Weight 184.28 g/mol
Molecular Formula C11H20O2
Exact Mass 184.14633 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1qaB6LK4ZYZ
Name 3-Heptyne-2,5-diol, 6-methyl-5-(1-methylethyl)-
CAS Registry Number 63922-38-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H20O2
InChI InChI=1S/C11H20O2/c1-8(2)11(13,9(3)4)7-6-10(5)12/h8-10,12-13H,1-5H3
InChIKey VWLKPPQKBIODPH-UHFFFAOYSA-N
Molecular Weight 184.279 g/mol
SMILES OC(C#CC(C(C)C)(O)C(C)C)C
SPLASH splash10-0006-9500000000-df4b9abab49b436f60e4
Source of Spectrum H-60-756-0
Synonyms 5-Isopropyl-6-methyl-3-heptyne-2,5-diol 5-isopropyl-6-methyl-hept-3-yne-2,5-diol 6-Methyl-5-propan-2-yl-3-heptyne-2,5-diol 6-Methyl-5-propan-2-yl-hept-3-yne-2,5-diol
Wiley ID 1180889