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[2,2'-Bibicyclo[2.2.1]heptan]-3-ol, 3'-(dimethylamino)-, [1.alpha.,2.alpha.(1'R*,2'S*,3'R*,4'S*),3.beta.,4.alpha.]-
SpectraBase Compound ID 48wpDCGVoPy
InChI InChI=1S/C16H27NO/c1-17(2)15-11-5-3-9(7-11)13(15)14-10-4-6-12(8-10)16(14)18/h9-16,18H,3-8H2,1-2H3/t9-,10+,11+,12-,13-,14-,15+,16+/m0/s1
InChIKey JLDXGWBOANAMML-QEKWBQHMSA-N
Mol Weight 249.4 g/mol
Molecular Formula C16H27NO
Exact Mass 249.209264 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Lckdr7J11XK
Name [2,2'-Bibicyclo[2.2.1]heptan]-3-ol, 3'-(dimethylamino)-, [1.alpha.,2.alpha.(1'R*,2'S*,3'R*,4'S*),3.beta.,4.alpha.]-
Alternate Name(s) (1S,2R,4S)-3-[(1R,2S,3R,4S)-3-(dimethylamino)bicyclo[2.2.1]heptan-2-yl]bicyclo[2.2.1]heptan-2-ol 2-(3'-Dimethyl amino boran-2'-yl)boran-3-ol
CAS Registry Number 66950-35-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H27NO
InChI InChI=1S/C16H27NO/c1-17(2)15-11-5-3-9(7-11)13(15)14-10-4-6-12(8-10)16(14)18/h9-16,18H,3-8H2,1-2H3/t9-,10+,11+,12-,13-,14-,15+,16+/m0/s1
InChIKey JLDXGWBOANAMML-QEKWBQHMSA-N
Molecular Weight 249.398 g/mol
SMILES O[C@]1([C@]([C@@]2([C@@]3(C[C@]([C@]2(N(C)C)[H])(CC3)[H])[H])[H])([C@]2(C[C@@]1(CC2)[H])[H])[H])[H]
SPLASH splash10-000t-8690000000-d4bf468f8642fdee5444
Source of Spectrum C-100-2447-0
Wiley ID 1252415