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cis-1,5-diethylbicyclo[3.3.0]octane-3,7-dione bishydrazone
SpectraBase Compound ID 2PDVkswyn4E
InChI InChI=1S/C12H22N4/c1-3-11-5-9(15-13)7-12(11,4-2)8-10(6-11)16-14/h3-8,13-14H2,1-2H3/b15-9-,16-10+/t11-,12+/m0/s1
InChIKey XLNPLFVVCXJJLP-BDIKIQMKSA-N
Mol Weight 222.34 g/mol
Molecular Formula C12H22N4
Exact Mass 222.184447 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8LhSlRGpwHq
Name cis-1,5-diethylbicyclo[3.3.0]octane-3,7-dione bishydrazone
Appearance White needles
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Formula C12H22N4
InChI InChI=1S/C12H22N4/c1-3-11-5-9(15-13)7-12(11,4-2)8-10(6-11)16-14/h3-8,13-14H2,1-2H3/b15-9-,16-10+/t11-,12+/m0/s1
InChIKey XLNPLFVVCXJJLP-BDIKIQMKSA-N
Instrument Name Agilent 5975 GC-122-5532 DB-5MS
Ionization Type EI
Literature Reference DOI 10.1021/jm401340p
Molecular Weight 222.336 g/mol
SMILES N\N=C\1C[C@]2([C@](C\C(=N\N)C2)(C1)CC)CC
SPLASH splash10-0pb9-1890000000-623c04b7a5bfafc97da7
Sample Comments anti-isomer
Source of Spectrum AF-56-SM5-18c
Wiley ID 1865447