(6R)-4-[(1-Methyl-1H-pyrazol-4-yl)methyl]-6-[4-(trifluoromethyl)phenoxy]-1,4-oxazepane

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Systematic / IUPAC Name: (6R)-4-[(1-Methylpyrazol-4-yl)methyl]-6-[4-(trifluoromethyl)phenoxy]-1,4-oxazepane

ID: Reference11747

Other Names: NAT47-548919

Formula: C17H20F3N3O2

Spectral Data

(6R)-4-[(1-Methyl-1H-pyrazol-4-yl)methyl]-6-[4-(trifluoromethyl)phenoxy]-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 305
Tandem Spectra MS1, MS2
Ionization Methods NSI
Analyzers FT
Last Modification 9/12/2022 12:42:06 PM
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Identificators

InChI InChI=1S/C17H20F3N3O2/c1-22-9-13(8-21-22)10-23-6-7-24-12-16(11-23)25-15-4-2-14(3-5-15)17(18,19)20/h2-5,8-9,16H,6-7,10-12H2,1H3/t16-/m1/s1
InChI Key QEJGAXLGXSJPHW-MRXNPFEDSA-N
Canonical SMILES CN1C=C(C=N1)CN2CCOCC(C2)OC3=CC=C(C=C3)C(F)(F)F
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Other Names NAT47-548919

In Other Databases

PubChem 75536871
ChemSpider 29855394