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1-(5-Methoxy-2-(3,3-dimethylbut-1-ynyl)phenyl)prop-2-ynyl acetate
SpectraBase Compound ID AH0uhQTudyF
InChI InChI=1S/C18H20O3/c1-7-17(21-13(2)19)16-12-15(20-6)9-8-14(16)10-11-18(3,4)5/h1,8-9,12,17H,2-6H3
InChIKey IWRSFADUCKGEMS-UHFFFAOYSA-N
Mol Weight 284.36 g/mol
Molecular Formula C18H20O3
Exact Mass 284.141245 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GwPAzPYoEvb
Name 1-(5-Methoxy-2-(3,3-dimethylbut-1-ynyl)phenyl)prop-2-ynyl acetate
Alternate Name(s) 1-(2-(3,3-dimethylbut-1-yn-1-yl)-5-methoxyphenyl)prop-2-yn-1-yl acetate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H20O3
InChI InChI=1S/C18H20O3/c1-7-17(21-13(2)19)16-12-15(20-6)9-8-14(16)10-11-18(3,4)5/h1,8-9,12,17H,2-6H3
InChIKey IWRSFADUCKGEMS-UHFFFAOYSA-N
Literature Reference DOI 10.1002/adsc.201300572
Molecular Weight 284.355 g/mol
SMILES c1(C#CC(C)(C)C)c(cc(cc1)OC)C(C#C)OC(C)=O
SPLASH splash10-00gi-4090000000-4bbc4f52664fb3e84648
Source of Spectrum ASC-355-2481/SM13-1c
Wiley ID 1761740