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Ethyl 4-[(2,4-Di-tert-butyl-6-methoxyphenyl)ethynyl]benzoate
SpectraBase Compound ID JrF9sJ44Hzy
InChI InChI=1S/C26H32O3/c1-9-29-24(27)19-13-10-18(11-14-19)12-15-21-22(26(5,6)7)16-20(25(2,3)4)17-23(21)28-8/h10-11,13-14,16-17H,9H2,1-8H3
InChIKey RZZXVWHEEYZIOJ-UHFFFAOYSA-N
Mol Weight 392.5 g/mol
Molecular Formula C26H32O3
Exact Mass 392.235145 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8DyG2XyUHyc
Name Ethyl 4-[(2,4-Di-tert-butyl-6-methoxyphenyl)ethynyl]benzoate
Alternate Name(s) Ethyl 4-((2,4-di-tert-butyl-6-methoxyphenyl)ethynyl)benzoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H32O3
InChI InChI=1S/C26H32O3/c1-9-29-24(27)19-13-10-18(11-14-19)12-15-21-22(26(5,6)7)16-20(25(2,3)4)17-23(21)28-8/h10-11,13-14,16-17H,9H2,1-8H3
InChIKey RZZXVWHEEYZIOJ-UHFFFAOYSA-N
Literature Reference DOI 10.1002/cmdc.200900015
Molecular Weight 392.539 g/mol
SMILES C(=O)(OCC)c1ccc(cc1)C#Cc1c(cc(cc1OC)C(C)(C)C)C(C)(C)C
SPLASH splash10-002f-0009000000-ab46cd784170849303ba
Source of Spectrum CMC-4-780/SM5-13
Wiley ID 1771616