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3,3-dimethyl-2-phenyl-2-oxiranecarbonitrile
SpectraBase Compound ID G5Mw6klhC6o
InChI InChI=1S/C11H11NO/c1-10(2)11(8-12,13-10)9-6-4-3-5-7-9/h3-7H,1-2H3
InChIKey QYZLROUWJUJIEL-UHFFFAOYSA-N
Mol Weight 173.21 g/mol
Molecular Formula C11H11NO
Exact Mass 173.084064 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3GMyQ53GEjb
Name 3,3-dimethyl-2-phenyl-2-oxiranecarbonitrile
Alternate Name(s) 3,3-dimethyl-2-phenyl-oxirane-2-carbonitrile
Comments Less than 3 mono-isotopic peaks
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Formula C11H11NO
InChI InChI=1S/C11H11NO/c1-10(2)11(8-12,13-10)9-6-4-3-5-7-9/h3-7H,1-2H3
InChIKey QYZLROUWJUJIEL-UHFFFAOYSA-N
Molecular Weight 173.215 g/mol
SMILES C1(OC1(C)C)(C#N)c1ccccc1
SPLASH splash10-014i-0900000000-e39ddcfe4672fb65cf13
Source of Spectrum J-58-6197-2
Wiley ID 1169909