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2-(P-tolyl)-4-(trifluoromethyl)benzo[b]oxepine
SpectraBase Compound ID CP3EidE1K3l
InChI InChI=1S/C18H13F3O/c1-12-6-8-13(9-7-12)17-11-15(18(19,20)21)10-14-4-2-3-5-16(14)22-17/h2-11H,1H3
InChIKey RPBBUZVZGCRYOF-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 FkquShQ2QL
Name 2-(P-tolyl)-4-(trifluoromethyl)benzo[b]oxepine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H13F3O
InChI InChI=1S/C18H13F3O/c1-12-6-8-13(9-7-12)17-11-15(18(19,20)21)10-14-4-2-3-5-16(14)22-17/h2-11H,1H3
InChIKey RPBBUZVZGCRYOF-UHFFFAOYSA-N
Literature Reference DOI 10.1002/adsc.201200784
Molecular Weight 302.296 g/mol
SMILES c1ccc2c(C=C(C=C(c3ccc(cc3)C)O2)C(F)(F)F)c1
SPLASH splash10-0gb9-2917000000-46c4a18224618957660b
Source of Spectrum ASC-355-n/a/SM2-4
Wiley ID 1761901