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4-(2,2-Dicyanoethyl)phenyl acetate
SpectraBase Compound ID LZ24JwtGXgz
InChI InChI=1S/C12H10N2O2/c1-9(15)16-12-4-2-10(3-5-12)6-11(7-13)8-14/h2-5,11H,6H2,1H3
InChIKey GFYCWXXPCVXNKF-UHFFFAOYSA-N
Mol Weight 214.22 g/mol
Molecular Formula C12H10N2O2
Exact Mass 214.074228 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KEmMSAspfXv
Name 4-(2,2-Dicyanoethyl)phenyl acetate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H10N2O2
InChI InChI=1S/C12H10N2O2/c1-9(15)16-12-4-2-10(3-5-12)6-11(7-13)8-14/h2-5,11H,6H2,1H3
InChIKey GFYCWXXPCVXNKF-UHFFFAOYSA-N
Instrument Name Thermo Finnigan TSQ 700
Ionization Type EI
Literature Reference DOI 10.1002/anie.201908372
Molecular Weight 214.224 g/mol
Reported Formula C11H10N2S
SMILES C(#N)C(Cc1ccc(cc1)OC(C)=O)C#N
SPLASH splash10-000t-0910000000-821934a79376870c4d6a
Source of Spectrum ACI-58-SM4-1e
Wiley ID 1875689