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2-Methoxy-5-methyl-1,3-di(pent-4-ynyl)benzene
SpectraBase Compound ID 52QlEQ2Ts3a
InChI InChI=1S/C18H22O/c1-5-7-9-11-16-13-15(3)14-17(18(16)19-4)12-10-8-6-2/h1-2,13-14H,7-12H2,3-4H3
InChIKey BZUCQYBSUMXGQY-UHFFFAOYSA-N
Mol Weight 254.37 g/mol
Molecular Formula C18H22O
Exact Mass 254.167065 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IOPM390WGM2
Name 2-Methoxy-5-methyl-1,3-di(pent-4-ynyl)benzene
Alternate Name(s) 2-Methoxy-5-methyl-1,3-di(pent-4-yn-1-yl)benzene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H22O
InChI InChI=1S/C18H22O/c1-5-7-9-11-16-13-15(3)14-17(18(16)19-4)12-10-8-6-2/h1-2,13-14H,7-12H2,3-4H3
InChIKey BZUCQYBSUMXGQY-UHFFFAOYSA-N
Literature Reference DOI 10.1002/anie.201206785
Molecular Weight 254.373 g/mol
SMILES c1(c(c(cc(c1)C)CCCC#C)OC)CCCC#C
SPLASH splash10-0uki-1690000000-128a3ab6976f7f253e9a
Source of Spectrum ACI-52-SM4-1b
Wiley ID 1780893