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3-Heptyne-2,5-diol, 6-methyl-5-(1-methylethyl)-, 2-acetate
SpectraBase Compound ID 69RoEHocYI5
InChI InChI=1S/C13H22O3/c1-9(2)13(15,10(3)4)8-7-11(5)16-12(6)14/h9-11,15H,1-6H3
InChIKey UBFSVILBKSBZQG-UHFFFAOYSA-N
Mol Weight 226.32 g/mol
Molecular Formula C13H22O3
Exact Mass 226.156895 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ik2OYvpZRwK
Name 3-HEPTYNE-2,5-DIOL, 6-METHYL-5-(1-METHYLETHYL)-, 2-ACETATE
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C13H22O3
InChI InChI=1S/C13H22O3/c1-9(2)13(15,10(3)4)8-7-11(5)16-12(6)14/h9-11,15H,1-6H3
InChIKey UBFSVILBKSBZQG-UHFFFAOYSA-N
Molecular Weight 226.1563
SMILES OC(C#CC(OC(=O)C)C)(C(C)C)C(C)C
SPLASH splash10-007o-9500000000-04cec966785655ab5975
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany