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1,3-Diazatricyclo[3.3.1.1(3,7)]decan-6-one, 5-butyl-7-methyl-2-(3-pyridinyl)-
SpectraBase Compound ID JaAMYtM7KBf
InChI InChI=1S/C18H25N3O/c1-3-4-7-18-12-20-10-17(2,16(18)22)11-21(13-18)15(20)14-6-5-8-19-9-14/h5-6,8-9,15H,3-4,7,10-13H2,1-2H3/t15?,17-,18+
InChIKey XGSRYCFCIYLEEO-ZNXRZULTSA-N
Mol Weight 299.42 g/mol
Molecular Formula C18H25N3O
Exact Mass 299.199762 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1r0992iUkcF
Name 1,3-Diazatricyclo[3.3.1.1(3,7)]decan-6-one, 5-butyl-7-methyl-2-(3-pyridinyl)-
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H25N3O
InChI InChI=1S/C18H25N3O/c1-3-4-7-18-12-20-10-17(2,16(18)22)11-21(13-18)15(20)14-6-5-8-19-9-14/h5-6,8-9,15H,3-4,7,10-13H2,1-2H3/t15?,17-,18+
InChIKey XGSRYCFCIYLEEO-ZNXRZULTSA-N
Molecular Weight 299.418 g/mol
SMILES [C@]12(C([C@@]3(CN(C2)C(N(C1)C3)c1cnccc1)CCCC)=O)C
SPLASH splash10-0536-9670000000-e4ab1a9dd4aa58f433eb
Source of Spectrum IY-1-4461-9
Wiley ID 1652602