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(1R,2R)-10-(9-Azabicyclo[3.3.1]nonan-9-yl)isoborneol
SpectraBase Compound ID 3WXelIbkYxY
InChI InChI=1S/C18H31NO/c1-17(2)13-9-10-18(17,16(20)11-13)12-19-14-5-3-6-15(19)8-4-7-14/h13-16,20H,3-12H2,1-2H3/t13-,14-,15+,16+,18+/m0/s1
InChIKey ISNBWSFYNYWHJD-ZNFSNMQZSA-N
Mol Weight 277.45 g/mol
Molecular Formula C18H31NO
Exact Mass 277.240565 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 55l6ISKWWci
Name (1R,2R)-10-(9-Azabicyclo[3.3.1]nonan-9-yl)isoborneol
Alternate Name(s) (1R,2R)-1-(9-azabicyclo[3.3.1]non-9-ylmethyl)-7,7-dimethylbicyclo[2.2.1]heptan-2-ol
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H31NO
InChI InChI=1S/C18H31NO/c1-17(2)13-9-10-18(17,16(20)11-13)12-19-14-5-3-6-15(19)8-4-7-14/h13-16,20H,3-12H2,1-2H3/t13-,14-,15+,16+,18+/m0/s1
InChIKey ISNBWSFYNYWHJD-ZNFSNMQZSA-N
Molecular Weight 277.452 g/mol
SMILES O[C@]1([C@]2(C([C@@](CC2)(C1)[H])(C)C)CN1[C@]2(CCC[C@@]1(CCC2)[H])[H])[H]
SPLASH splash10-004i-0940000000-9bd98d4f1ee4a002c6bf
Source of Spectrum C5-2005-587-1
Wiley ID 1618153