1,8-Diazabicyclo [5.4.0]undec-7-ene

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Systematic / IUPAC Name: 2,3,4,6,7,8,9,10-Octahydropyrimido[1,2-a]azepine

ID: Reference3088

Other Names: 2,3,4,6,7,8,9,10-Octahydropyrimido[1,2-α]azepine ;
2,3,4,6,7,8,9,10-Octahydropyrimidol[1,2-a]azepine;
2H,3H,4H,6H,7H,8H,9H,10H-Pyrimido[1,2-a]azepine;
DBU;
Pyrimido[1,2-a]azepine, 2,3,4,6,7,8,9,10-octahydro- ; more

Formula: C9H16N2

Class: Endogenous Metabolites

Spectral Data

1,8-Diazabicyclo [5.4.0]undec-7-ene mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

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Available MS Data

Used Instruments Q Exactive Orbitrap
No. of Spectral Trees 2
No. of Spectra 238
Tandem Spectra MS1, MS2
Ionization Methods ESI; APCI
Analyzers FT
Last Modification 10/8/2015 11:43:55 AM
View Mass Spec Data > >

Identificators

InChI InChI=1S/C9H16N2/c1-2-5-9-10-6-4-8-11(9)7-3-1/h1-8H2
InChI Key GQHTUMJGOHRCHB-UHFFFAOYSA-N
Canonical SMILES C1CCC2=NCCCN2CC1
CAS 6674222
Splash
Other Names 2,3,4,6,7,8,9,10-Octahydropyrimido[1,2-α]azepine ;
2,3,4,6,7,8,9,10-Octahydropyrimidol[1,2-a]azepine;
2H,3H,4H,6H,7H,8H,9H,10H-Pyrimido[1,2-a]azepine;
DBU;
Pyrimido[1,2-a]azepine, 2,3,4,6,7,8,9,10-octahydro-;
1,5-Diazabicyclo[5.4.0]-5-undecene;
1,5-Diazabicycloundec-5-ene ;
1,8-Diazabicyclo[5.4.0]undec-7-ene ;
1,8-Diazabicyclo[5,4,0]undec-7-ene;
1,8-Diazabicyclo[5.4.0]-7-undecene;
2,3,4,5-Tetrahydro-6H,7H,8H,9H,10H-pyrimidino[1,2-a]azaperhydroepine

In Other Databases

Wikipedia 1,8-Diazabicycloundec-7-ene
PubChem 81184
ChEMBL CHEMBL1489129
ChemIDPlus 006674222; 063817787
ChemSpider 73246