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1,3-Benzenedicarbonitrile, 5-(2-hydroxy-1,1-dimethylpropyl)-
SpectraBase Compound ID 7bqCXIB74uV
InChI InChI=1S/C13H14N2O/c1-9(16)13(2,3)12-5-10(7-14)4-11(6-12)8-15/h4-6,9,16H,1-3H3
InChIKey SQJHPDTVEFTZNC-UHFFFAOYSA-N
Mol Weight 214.27 g/mol
Molecular Formula C13H14N2O
Exact Mass 214.110613 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 74C5o6eNSJ4
Name 1,3-Benzenedicarbonitrile, 5-(2-hydroxy-1,1-dimethylpropyl)-
CAS Registry Number 127921-62-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H14N2O
InChI InChI=1S/C13H14N2O/c1-9(16)13(2,3)12-5-10(7-14)4-11(6-12)8-15/h4-6,9,16H,1-3H3
InChIKey SQJHPDTVEFTZNC-UHFFFAOYSA-N
Molecular Weight 214.268 g/mol
SMILES OC(C(c1cc(C#N)cc(C#N)c1)(C)C)C
SPLASH splash10-00di-0900000000-4ccdb344599a607cb90c
Source of Spectrum KC-1990-191-5
Synonyms 5-(1,1-Dimethyl-2-hydroxy-propyl)-1,3-dicyanobenzene 5-(2-hydroxy-1,1-dimethylpropyl)isophthalonitrile
Wiley ID 1213799