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10,12-docosadiynedioic acid, monomethyl ester

View entire compound with spectra: 1 MS (GC)

10,12-docosadiynedioic acid, monomethyl ester
SpectraBase Compound ID Bsx66EfEWxu
InChI InChI=1S/C23H36O4/c1-27-23(26)21-19-17-15-13-11-9-7-5-3-2-4-6-8-10-12-14-16-18-20-22(24)25/h6-21H2,1H3,(H,24,25)
InChIKey GYUOASJGXBTBIS-UHFFFAOYSA-N
Mol Weight 376.5 g/mol
Molecular Formula C23H36O4
Exact Mass 376.26136 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EONFEgwADQa
Name 10,12-docosadiynedioic acid, monomethyl ester
Alternate Name(s) 22-Methoxy-22-oxodocosa-10,12-diynoic acid 22-Methoxy-22-oxo-docosa-10,12-diynoic acid 22-Methoxy-22-oxidanylidene-docosa-10,12-diynoic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H36O4
InChI InChI=1S/C23H36O4/c1-27-23(26)21-19-17-15-13-11-9-7-5-3-2-4-6-8-10-12-14-16-18-20-22(24)25/h6-21H2,1H3,(H,24,25)
InChIKey GYUOASJGXBTBIS-UHFFFAOYSA-N
Molecular Weight 376.537 g/mol
SMILES OC(CCCCCCCCC#CC#CCCCCCCCCC(OC)=O)=O
SPLASH splash10-05nf-9810000000-4314a7e37605633c2e51
Source of Spectrum JX-2015-3-1614
Wiley ID 1725091