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3-(1'-Adamantyl)-4,5,6-tri(t-butyl)pyridazine
SpectraBase Compound ID Gg1xpcEFtMz
InChI InChI=1S/C26H42N2/c1-23(2,3)19-20(24(4,5)6)22(28-27-21(19)25(7,8)9)26-13-16-10-17(14-26)12-18(11-16)15-26/h16-18H,10-15H2,1-9H3/t16-,17+,18-,26-
InChIKey AYIRHVYMWQPPKE-VKWXMXRMSA-N
Mol Weight 382.6 g/mol
Molecular Formula C26H42N2
Exact Mass 382.334799 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DUrlYJ3dxED
Name 3-(1'-Adamantyl)-4,5,6-tri(t-butyl)pyridazine
Alternate Name(s) 3-(1-adamantyl)-4,5,6-tritert-butylpyridazine
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Formula C26H42N2
InChI InChI=1S/C26H42N2/c1-23(2,3)19-20(24(4,5)6)22(28-27-21(19)25(7,8)9)26-13-16-10-17(14-26)12-18(11-16)15-26/h16-18H,10-15H2,1-9H3/t16-,17+,18-,26-
InChIKey AYIRHVYMWQPPKE-VKWXMXRMSA-N
Molecular Weight 382.636 g/mol
SMILES C12(c3c(c(C(C)(C)C)c(nn3)C(C)(C)C)C(C)(C)C)C[C@]3(C[C@@](C1)(C[C@@](C2)(C3)[H])[H])[H]
SPLASH splash10-004i-0029000000-51e053ef51c946a82b70
Source of Spectrum U-1995-181-17
Wiley ID 766551