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1,4:5,8-Dimethanophthalazine, 1,4,4a,5,8,8a-hexahydro-10,10-dimethyl-, (1.alpha.,4.alpha.,4a.alpha.,5.beta.,8.beta.,8a.alpha.)-

View entire compound with spectra: 1 MS (GC)

1,4:5,8-Dimethanophthalazine, 1,4,4a,5,8,8a-hexahydro-10,10-dimethyl-, (1.alpha.,4.alpha.,4a.alpha.,5.beta.,8.beta.,8a.alpha.)-
SpectraBase Compound ID DjUG7pBtaRj
InChI InChI=1S/C12H16N2/c1-12(2)6-3-4-7(12)11-9-5-8(10(6)11)13-14-9/h3-4,6-11H,5H2,1-2H3/t6-,7+,8+,9-,10+,11-
InChIKey MZSJQWNQZZYVSD-MXULBQIISA-N
Mol Weight 188.27 g/mol
Molecular Formula C12H16N2
Exact Mass 188.131349 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4vFzMmXkgYP
Name 1,4:5,8-Dimethanophthalazine, 1,4,4a,5,8,8a-hexahydro-10,10-dimethyl-, (1.alpha.,4.alpha.,4a.alpha.,5.beta.,8.beta.,8a.alpha.)-
CAS Registry Number 89703-41-3
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H16N2
InChI InChI=1S/C12H16N2/c1-12(2)6-3-4-7(12)11-9-5-8(10(6)11)13-14-9/h3-4,6-11H,5H2,1-2H3/t6-,7+,8+,9-,10+,11-
InChIKey MZSJQWNQZZYVSD-MXULBQIISA-N
Molecular Weight 188.274 g/mol
SMILES [C@@]12([C@]3([C@@]([C@]4([H])C[C@]3(N=N4)[H])([H])[C@@](C1(C)C)([H])C=C2)[H])[H]
SPLASH splash10-002f-9000000000-d659878b86647c76be36
Source of Spectrum K-117-527-0
Synonyms (1R,2R,3S,6R,7S,8S)-11,11-dimethyl-4,5-diazatetracyclo[6.2.1.1(3,6).0(2,7)]dodeca-4,9-diene exo-(c-4a,c-8a)-1,4,4a,5,8,8a-hexahydro-10,10-dimethyl-r-1,c-4:t-5,t-8-dimethanophthalazine
Wiley ID 1185036