(6R)-4-(4-Fluorobenzyl)-6-{[5-(trifluoromethyl)-2-pyridinyl]oxy}-1,4-oxazepane

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Systematic / IUPAC Name: (6R)-4-[(4-Fluorophenyl)methyl]-6-[5-(trifluoromethyl)pyridin-2-yl]oxy-1,4-oxazepane

ID: Reference12690

Other Names: NAT47-547463

Formula: C18H18F4N2O2

Spectral Data

(6R)-4-(4-Fluorobenzyl)-6-{[5-(trifluoromethyl)-2-pyridinyl]oxy}-1,4-oxazepane mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

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Available MS Data

Used Instruments Orbitrap Fusion Lumos with ETD LBP
No. of Spectral Trees 1
No. of Spectra 420
Tandem Spectra MS1, MS2, MS3, MS4
Ionization Methods NSI
Analyzers FT
Last Modification 7/31/2023 11:12:20 AM
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Identificators

InChI InChI=1S/C18H18F4N2O2/c19-15-4-1-13(2-5-15)10-24-7-8-25-12-16(11-24)26-17-6-3-14(9-23-17)18(20,21)22/h1-6,9,16H,7-8,10-12H2/t16-/m1/s1
InChI Key ZLYBLPSSLGRZMX-MRXNPFEDSA-N
Canonical SMILES C1COCC(CN1CC2=CC=C(C=C2)F)OC3=NC=C(C=C3)C(F)(F)F
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Other Names NAT47-547463

In Other Databases

ChemSpider 29855369
PubChem 75411571