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(1S,4R,5R)-6,6-Dicyano-4-(1-menthyloxy)-3-oxabicyclo[3.1.0]hexan-2-one
SpectraBase Compound ID RmnYfsDMJk
InChI InChI=1S/C17H22N2O3/c1-9(2)11-5-4-10(3)6-12(11)21-16-14-13(15(20)22-16)17(14,7-18)8-19/h9-14,16H,4-6H2,1-3H3/t10?,11?,12?,13-,14+,16+/m0/s1
InChIKey XXICCCRRJCTMPT-CAFWQSLQSA-N
Mol Weight 302.37 g/mol
Molecular Formula C17H22N2O3
Exact Mass 302.163043 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6ecRxrCPl60
Name (1S,4R,5R)-6,6-Dicyano-4-(1-menthyloxy)-3-oxabicyclo[3.1.0]hexan-2-one
Alternate Name(s) (1R,4R,5S)-6,6-Dicyano-4-(menthyloxy)-3-oxabicyclo[3.1.0]hexan-2-one (1S,2R,5R)-2-[(3-isopropyl-3-methylcyclohexyl)oxy]-4-oxo-3-oxabicyclo[3.1.0]hexane-6,6-dicarbonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H22N2O3
InChI InChI=1S/C17H22N2O3/c1-9(2)11-5-4-10(3)6-12(11)21-16-14-13(15(20)22-16)17(14,7-18)8-19/h9-14,16H,4-6H2,1-3H3/t10?,11?,12?,13-,14+,16+/m0/s1
InChIKey XXICCCRRJCTMPT-CAFWQSLQSA-N
Molecular Weight 302.374 g/mol
SMILES C1([C@@]2(C(=O)O[C@]([C@]12[H])(OC1C(CCC(C1)C)C(C)C)[H])[H])(C#N)C#N
SPLASH splash10-001j-9200000000-94a58e04b3d75ee07009
Source of Spectrum QC-10-3598-4
Wiley ID 871632