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Methylpentynol
SpectraBase Compound ID AlyorbW9OlQ
InChI InChI=1S/C6H10O/c1-4-6(3,7)5-2/h1,7H,5H2,2-3H3
InChIKey QXLPXWSKPNOQLE-UHFFFAOYSA-N
Mol Weight 98.14 g/mol
Molecular Formula C6H10O
Exact Mass 98.073165 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4V335MFNY81
Name 3-methylpent-1-yn-3-ol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C6H10O
InChI InChI=1S/C6H10O/c1-4-6(3,7)5-2/h1,7H,5H2,2-3H3
InChIKey QXLPXWSKPNOQLE-UHFFFAOYSA-N
Instrument Name Agilent 6890N-Agilent 5973
Ionization Type EI
Literature Reference DOI 10.1021/acs.joc.2c00616
Molecular Weight 98.145 g/mol
Quality 962
SMILES OC(C#C)(CC)C
SPLASH splash10-014l-9000000000-2b2683ebfc34e15b1987
Source of Spectrum JOC-88-SM27-27-1 (DOI: 10.1021/acs.joc.2c00616)
Wiley ID 1912570