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4,6-Dioxatricyclo[3.3.1.02,7]nonane-1-carbonitrile, 3,3-dimethyl-, (1R)-
SpectraBase Compound ID I4snVrT5Y6y
InChI InChI=1S/C10H13NO2/c1-9(2)8-6-3-10(8,5-11)4-7(12-6)13-9/h6-8H,3-4H2,1-2H3/t6?,7?,8?,10-/m0/s1
InChIKey GPABVPZHLIBZCK-RKSFOETPSA-N
Mol Weight 179.22 g/mol
Molecular Formula C10H13NO2
Exact Mass 179.094629 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1adDPNEFNZN
Name 4,6-Dioxatricyclo[3.3.1.02,7]nonane-1-carbonitrile, 3,3-dimethyl-, (1R)-
Alternate Name(s) (1R)-3,3-dimethyl-4,6-dioxatricyclo[3.3.1.0(2,7)]nonane-1-carbonitrile (1R,4S,5R,7S)-7-cyano-3,3-dimethyl-2,9-dioxatricyclo[3.3.1.0(4,7)]nonane
CAS Registry Number 99656-24-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H13NO2
InChI InChI=1S/C10H13NO2/c1-9(2)8-6-3-10(8,5-11)4-7(12-6)13-9/h6-8H,3-4H2,1-2H3/t6?,7?,8?,10-/m0/s1
InChIKey GPABVPZHLIBZCK-RKSFOETPSA-N
Molecular Weight 179.219 g/mol
SMILES [C@@]12(C3C(C)(C)OC(C2)OC3C1)C#N
SPLASH splash10-01x9-6900000000-6736ec5a61647a9063ae
Source of Spectrum J-50-5655-25
Wiley ID 1175279