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8-Methyl-2-phenyl-4-(trifluoromethyl)benzo[b]oxepine
SpectraBase Compound ID 6lh4r4dXvFw
InChI InChI=1S/C18H13F3O/c1-12-7-8-14-10-15(18(19,20)21)11-17(22-16(14)9-12)13-5-3-2-4-6-13/h2-11H,1H3
InChIKey AXPKHLUMSFKDOF-UHFFFAOYSA-N
Mol Weight 302.3 g/mol
Molecular Formula C18H13F3O
Exact Mass 302.09185 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EynngP791ID
Name 8-Methyl-2-phenyl-4-(trifluoromethyl)benzo[b]oxepine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H13F3O
InChI InChI=1S/C18H13F3O/c1-12-7-8-14-10-15(18(19,20)21)11-17(22-16(14)9-12)13-5-3-2-4-6-13/h2-11H,1H3
InChIKey AXPKHLUMSFKDOF-UHFFFAOYSA-N
Literature Reference DOI 10.1002/adsc.201200784
Molecular Weight 302.296 g/mol
SMILES c1c(cc2c(C=C(C=C(c3ccccc3)O2)C(F)(F)F)c1)C
SPLASH splash10-0zfr-2739000000-ff67fd695522ddccb620
Source of Spectrum ASC-355-n/a/SM11-20
Wiley ID 1761893