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Hexa-2,4-diyn-1,6-diyl bis(2-azidobenzoate)
SpectraBase Compound ID BuXZJTc70KS
InChI InChI=1S/C20H12N6O4/c21-25-23-17-11-5-3-9-15(17)19(27)29-13-7-1-2-8-14-30-20(28)16-10-4-6-12-18(16)24-26-22/h3-6,9-12H,13-14H2
InChIKey RQTFJMGJCHYJRL-UHFFFAOYSA-N
Mol Weight 400.35 g/mol
Molecular Formula C20H12N6O4
Exact Mass 400.092003 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KaijLIBDLgn
Name Hexa-2,4-diyn-1,6-diyl bis(2-azidobenzoate)
Alternate Name(s) Hexa-2,4-diyne-1,6-diyl bis(2-azidobenzoate)
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H12N6O4
InChI InChI=1S/C20H12N6O4/c21-25-23-17-11-5-3-9-15(17)19(27)29-13-7-1-2-8-14-30-20(28)16-10-4-6-12-18(16)24-26-22/h3-6,9-12H,13-14H2
InChIKey RQTFJMGJCHYJRL-UHFFFAOYSA-N
Molecular Weight 400.354 g/mol
SMILES c1(N=[N+]=[N-])c(C(=O)OCC#CC#CCOC(c2c(N=[N+]=[N-])cccc2)=O)cccc1
SPLASH splash10-00di-3921000000-ffaec04764089e526782
Source of Spectrum Y-50-532-2d
Wiley ID 1736690