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2,3-Bis[[(N,N-pentamethyleneamino)carbonyl]ethynyl]-7-oxabicyclo[2.2.1]hepta-2,5-diene
SpectraBase Compound ID 96dsWkreTWg
InChI InChI=1S/C22H24N2O3/c25-21(23-13-3-1-4-14-23)11-7-17-18(20-10-9-19(17)27-20)8-12-22(26)24-15-5-2-6-16-24/h9-10,19-20H,1-6,13-16H2/t19-,20+
InChIKey SGKRFGUJMJJAKU-BGYRXZFFSA-N
Mol Weight 364.45 g/mol
Molecular Formula C22H24N2O3
Exact Mass 364.178693 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Kk0OX3TnuKy
Name 2,3-Bis[[(N,N-pentamethyleneamino)carbonyl]ethynyl]-7-oxabicyclo[2.2.1]hepta-2,5-diene
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Formula C22H24N2O3
InChI InChI=1S/C22H24N2O3/c25-21(23-13-3-1-4-14-23)11-7-17-18(20-10-9-19(17)27-20)8-12-22(26)24-15-5-2-6-16-24/h9-10,19-20H,1-6,13-16H2/t19-,20+
InChIKey SGKRFGUJMJJAKU-BGYRXZFFSA-N
Molecular Weight 364.445 g/mol
SMILES C1(=C(C#CC(N2CCCCC2)=O)[C@@]2(O[C@]1(C=C2)[H])[H])C#CC(N1CCCCC1)=O
SPLASH splash10-001i-9000000000-96fe09da1c31cef1746e
Source of Spectrum J-61-6165-3
Synonyms 1-(3-{3-[3-oxo-3-(1-piperidinyl)-1-propynyl]-7-oxabicyclo[2.2.1]hepta-2,5-dien-2-yl}-2-propynoyl)piperidine
Wiley ID 1350993