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2-Hex-4-ynoyl-3,5-dimethoxy-phenylacetic acid 1-methylpent-3-ynyl ester
SpectraBase Compound ID 5Vekdm7ZeBl
InChI InChI=1S/C22H26O5/c1-6-8-10-12-19(23)22-17(13-18(25-4)15-20(22)26-5)14-21(24)27-16(3)11-9-7-2/h13,15-16H,10-12,14H2,1-5H3
InChIKey AVBNZBDODMFJMQ-UHFFFAOYSA-N
Mol Weight 370.45 g/mol
Molecular Formula C22H26O5
Exact Mass 370.178024 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2nnInDEeXBV
Name 2-Hex-4-ynoyl-3,5-dimethoxy-phenylacetic acid 1-methylpent-3-ynyl ester
Alternate Name(s) 2-Hex-4-ynoyl-3,5-dimethoxyphenylacetic acid 1-methylpent-3-ynyl ester 1-Methyl-3-pentynyl[2-(4-hexynoyl)-3,5-dimethoxyphenyl]acetate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H26O5
InChI InChI=1S/C22H26O5/c1-6-8-10-12-19(23)22-17(13-18(25-4)15-20(22)26-5)14-21(24)27-16(3)11-9-7-2/h13,15-16H,10-12,14H2,1-5H3
InChIKey AVBNZBDODMFJMQ-UHFFFAOYSA-N
Molecular Weight 370.445 g/mol
SMILES c1(c(c(cc(c1)OC)OC)C(CCC#CC)=O)CC(=O)OC(CC#CC)C
SPLASH splash10-00di-1290000000-df4092e817e0cd491389
Source of Spectrum F-68-1526-21
Wiley ID 1571906