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3-butyl-4-(1-piperidinyl)cyclobut-3-ene-1,2-dione
SpectraBase Compound ID 8JKZY9DV1Vc
InChI InChI=1S/C13H19NO2/c1-2-3-7-10-11(13(16)12(10)15)14-8-5-4-6-9-14/h2-9H2,1H3
InChIKey JBFVRPNUVROGON-UHFFFAOYSA-N
Mol Weight 221.3 g/mol
Molecular Formula C13H19NO2
Exact Mass 221.141579 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HUjVvESn8JK
Name 3-butyl-4-(1-piperidinyl)cyclobut-3-ene-1,2-dione
Alternate Name(s) 3-butyl-4-(1-piperidyl)cyclobut-3-ene-1,2-dione 3-butyl-4-piperidin-1-yl-cyclobut-3-ene-1,2-dione 3-butyl-4-piperidino-cyclobut-3-ene-1,2-quinone
Comments Less than 3 mono-isotopic peaks
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Formula C13H19NO2
InChI InChI=1S/C13H19NO2/c1-2-3-7-10-11(13(16)12(10)15)14-8-5-4-6-9-14/h2-9H2,1H3
InChIKey JBFVRPNUVROGON-UHFFFAOYSA-N
Molecular Weight 221.300 g/mol
SMILES C1(C(C(=C1N1CCCCC1)CCCC)=O)=O
SPLASH splash10-03di-0900000000-877be5cfc0ccb22905f9
Source of Spectrum K-2001-69-14
Wiley ID 1578308