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1,3-Dioxolane-2-butanenitrile, .alpha.-butyl-2-phenyl-
SpectraBase Compound ID 9aww3U6A0FI
InChI InChI=1S/C17H23NO2/c1-2-3-7-15(14-18)10-11-17(19-12-13-20-17)16-8-5-4-6-9-16/h4-6,8-9,15H,2-3,7,10-13H2,1H3
InChIKey ZZYAEAIQWLHWLN-UHFFFAOYSA-N
Mol Weight 273.38 g/mol
Molecular Formula C17H23NO2
Exact Mass 273.172879 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HtxlsS87t61
Name 1,3-Dioxolane-2-butanenitrile, .alpha.-butyl-2-phenyl-
CAS Registry Number 62623-46-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H23NO2
InChI InChI=1S/C17H23NO2/c1-2-3-7-15(14-18)10-11-17(19-12-13-20-17)16-8-5-4-6-9-16/h4-6,8-9,15H,2-3,7,10-13H2,1H3
InChIKey ZZYAEAIQWLHWLN-UHFFFAOYSA-N
Molecular Weight 273.376 g/mol
SMILES C1(OCCO1)(CCC(C#N)CCCC)c1ccccc1
SPLASH splash10-0002-0900000000-135006e0f6eec0e22e21
Source of Spectrum C-99-1539-0
Synonyms 1-Phenyl-1,1-dioxoethylene-4-cyanooctane 2-[2-(2-phenyl-1,3-dioxolan-2-yl)ethyl]hexanenitrile
Wiley ID 1277371