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2-Phenyl-4,7-bis(trifluoromethyl)benzo[b]oxepine
SpectraBase Compound ID 6a06pGLUIpS
InChI InChI=1S/C18H10F6O/c19-17(20,21)13-6-7-15-12(8-13)9-14(18(22,23)24)10-16(25-15)11-4-2-1-3-5-11/h1-10H
InChIKey KAPJQKXDCJADDD-UHFFFAOYSA-N
Mol Weight 356.27 g/mol
Molecular Formula C18H10F6O
Exact Mass 356.063584 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID vmSYabQhJh
Name 2-Phenyl-4,7-bis(trifluoromethyl)benzo[b]oxepine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H10F6O
InChI InChI=1S/C18H10F6O/c19-17(20,21)13-6-7-15-12(8-13)9-14(18(22,23)24)10-16(25-15)11-4-2-1-3-5-11/h1-10H
InChIKey KAPJQKXDCJADDD-UHFFFAOYSA-N
Literature Reference DOI 10.1002/adsc.201200784
Molecular Weight 356.267 g/mol
SMILES c1(ccc2c(C=C(C(F)(F)F)C=C(c3ccccc3)O2)c1)C(F)(F)F
SPLASH splash10-0a4i-2918000000-ce7f84449db9b85a6bcd
Source of Spectrum ASC-355-n/a/SM14-24
Wiley ID 1761897