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2H-benz[f]isoindole-1-carbonitrile, 2-(1,1-dimethylethyl)-
SpectraBase Compound ID C1mrI9hF0Kh
InChI InChI=1S/C17H16N2/c1-17(2,3)19-11-14-8-12-6-4-5-7-13(12)9-15(14)16(19)10-18/h4-9,11H,1-3H3
InChIKey LUMGONDQODQRGR-UHFFFAOYSA-N
Mol Weight 248.33 g/mol
Molecular Formula C17H16N2
Exact Mass 248.131349 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 84mEafbPqbY
Name 2H-benz[f]isoindole-1-carbonitrile, 2-(1,1-dimethylethyl)-
CAS Registry Number 103836-31-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H16N2
InChI InChI=1S/C17H16N2/c1-17(2,3)19-11-14-8-12-6-4-5-7-13(12)9-15(14)16(19)10-18/h4-9,11H,1-3H3
InChIKey LUMGONDQODQRGR-UHFFFAOYSA-N
Molecular Weight 248.329 g/mol
SMILES c1([n](cc2cc3ccccc3cc12)C(C)(C)C)C#N
SPLASH splash10-0006-1910000000-3ae2846f33dde91a0a7e
Source of Spectrum J-51-3981-7
Synonyms 2-tert-Butyl-2H-benzo[f]isoindole-1-carbonitrile
Wiley ID 1251751