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3-Heptyne-2,6-diol, 5,5-dimethyl-
SpectraBase Compound ID 36B033kHGpF
InChI InChI=1S/C9H16O2/c1-7(10)5-6-9(3,4)8(2)11/h7-8,10-11H,1-4H3
InChIKey KXNQCOMPVJNIQX-UHFFFAOYSA-N
Mol Weight 156.22 g/mol
Molecular Formula C9H16O2
Exact Mass 156.11503 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GuygzcceGcB
Name 3-Heptyne-2,6-diol, 5,5-dimethyl-
Alternate Name(s) 5,5-Dimethyl-3-heptyne-2,6-diol
CAS Registry Number 61228-11-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H16O2
InChI InChI=1S/C9H16O2/c1-7(10)5-6-9(3,4)8(2)11/h7-8,10-11H,1-4H3
InChIKey KXNQCOMPVJNIQX-UHFFFAOYSA-N
Molecular Weight 156.225 g/mol
SMILES OC(C#CC(C(O)C)(C)C)C
SPLASH splash10-0006-9000000000-ef6b15a92c9608c02d8d
Source of Spectrum C-98-8419-0
Wiley ID 1153674