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1,7,9-TRIMETHYL-12-[2-(PYRIDIN-2-YL)-ETHYL]-3,5-DIOXA-12-AZATETRACYCLO-[5.3.1.1(2,6).0(4,9)]-DODECANE
SpectraBase Compound ID EoJmgxBgNuI
InChI InChI=1S/C19H26N2O2/c1-17-10-18(2)12-19(3,11-17)16-22-14(17)21(15(18)23-16)9-7-13-6-4-5-8-20-13/h4-6,8,14-16H,7,9-12H2,1-3H3/t14-,15+,16-,17+,18-,19+
InChIKey VDGKDWQREQONDR-BAMLVTLESA-N
Mol Weight 314.43 g/mol
Molecular Formula C19H26N2O2
Exact Mass 314.199428 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EWodwF8ma6I
Name 1,7,9-Trimethyl-12-[2-(pyridin-2-yl)ethyl]-3,5-dioxa-12-azawurtzitane {1,7,9-trimethyl-12-[2-(pyridin-2-yl)ethyl]-3,5-dioxa-12-azatetracyclo[5.3.1.1(2,6).0(4,9)]dodecane}
Comments Less than 3 mono-isotopic peaks
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Formula C19H26N2O2
InChI InChI=1S/C19H26N2O2/c1-17-10-18(2)12-19(3,11-17)16-22-14(17)21(15(18)23-16)9-7-13-6-4-5-8-20-13/h4-6,8,14-16H,7,9-12H2,1-3H3/t14-,15+,16-,17+,18-,19+
InChIKey VDGKDWQREQONDR-BAMLVTLESA-N
Molecular Weight 314.429 g/mol
SMILES [C@]12(N([C@@]3(O[C@](O2)([C@@]2(C[C@]1(C[C@]3(C2)C)C)C)[H])[H])CCc1ncccc1)[H]
SPLASH splash10-03di-0029000000-f51beccdffe2def31134
Source of Spectrum KC-0-1927-4
Synonyms 1,7,9-trimethyl-12-[2-(2-pyridinyl)ethyl]-3,5-dioxa-12-azatetracyclo[5.3.1.1(2,6).0(4,9)]dodecane
Wiley ID 825667