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3-(1,3-Benzodioxol-5-yl)-2-[3-(trifluoromethyl)phenyl]-2-propenenitrile
SpectraBase Compound ID LIzjbp84E0Q
InChI InChI=1S/C17H10F3NO2/c18-17(19,20)14-3-1-2-12(8-14)13(9-21)6-11-4-5-15-16(7-11)23-10-22-15/h1-8H,10H2/b13-6+
InChIKey CFYCHUQXHAEIIL-AWNIVKPZSA-N
Mol Weight 317.27 g/mol
Molecular Formula C17H10F3NO2
Exact Mass 317.066363 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6KBqK155Gq1
Name 3-(1,3-Benzodioxol-5-yl)-2-[3-(trifluoromethyl)phenyl]-2-propenenitrile
Alternate Name(s) (Z)-3-(1,3-benzodioxol-5-yl)-2-[3-(trifluoromethyl)phenyl]-2-propenenitrile (Z)-3-(1,3-benzodioxol-5-yl)-2-[3-(trifluoromethyl)phenyl]acrylonitrile (Z)-3-(1,3-benzodioxol-5-yl)-2-[3-(trifluoromethyl)phenyl]prop-2-enenitrile
CAS Registry Number 132029-55-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H10F3NO2
InChI InChI=1S/C17H10F3NO2/c18-17(19,20)14-3-1-2-12(8-14)13(9-21)6-11-4-5-15-16(7-11)23-10-22-15/h1-8H,10H2/b13-6+
InChIKey CFYCHUQXHAEIIL-AWNIVKPZSA-N
Molecular Weight 317.267 g/mol
SMILES C(c1cc(\C(=C\c2cc3OCOc3cc2)C#N)ccc1)(F)(F)F
SPLASH splash10-014i-8947000000-329b91e55cef35c4cb2b
Source of Spectrum AD-0-2532-0
Wiley ID 1429037