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3,5-OCTADIYNE-1,8-DIYL_BIS-N-PHENYLCARBAMATE
SpectraBase Compound ID F1puWJ1PMuI
InChI InChI=1S/C22H20N2O4/c25-21(23-19-13-7-5-8-14-19)27-17-11-3-1-2-4-12-18-28-22(26)24-20-15-9-6-10-16-20/h5-10,13-16H,11-12,17-18H2,(H,23,25)(H,24,26)
InChIKey CTQSEIFHUYZPSY-UHFFFAOYSA-N
Mol Weight 376.41 g/mol
Molecular Formula C22H20N2O4
Exact Mass 376.142307 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KI5hezx9Nqz
Name 3,5-Octadiyne-1,8-diol, bis(phenylcarbamate)
Alternate Name(s) Octa-3,5-diyne-1,8-diyl bis(phenylcarbamate) N-phenylcarbamic acid 8-[anilino(oxo)methoxy]octa-3,5-diynyl ester 8-(Phenylcarbamoyloxy)octa-3,5-diynyl N-phenylcarbamate
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Formula C22H20N2O4
InChI InChI=1S/C22H20N2O4/c25-21(23-19-13-7-5-8-14-19)27-17-11-3-1-2-4-12-18-28-22(26)24-20-15-9-6-10-16-20/h5-10,13-16H,11-12,17-18H2,(H,23,25)(H,24,26)
InChIKey CTQSEIFHUYZPSY-UHFFFAOYSA-N
Molecular Weight 376.412 g/mol
SMILES N(C(OCCC#CC#CCCOC(=O)Nc1ccccc1)=O)c1ccccc1
SPLASH splash10-002u-9810000000-1a95f23291c33cc94b73
Source of Spectrum JX-2015-3-1612
Wiley ID 1725089