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JW 618

View entire compound with spectra: 1 MS (GC)

JW 618
SpectraBase Compound ID JQerMVTn2cF
InChI InChI=1S/C17H14F6N2O2/c1-25(15(26)27-14(16(18,19)20)17(21,22)23)10-11-3-2-4-13(9-11)12-5-7-24-8-6-12/h2-9,14H,10H2,1H3
InChIKey RBZKWMMBPOHSDF-UHFFFAOYSA-N
Mol Weight 392.3 g/mol
Molecular Formula C17H14F6N2O2
Exact Mass 392.095947 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B3i3ePIXBp2
Name JW 618
Alternate Name(s) 1,1,1,3,3,3-hexafluoropropan-2-yl-methyl(3-(pyridin-4-yl)benzyl)carbamate 1,1,1,3,3,3-hexafluoropropan-2-yl methyl(3-(pyridin-4-yl)benzyl)carbamate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H14F6N2O2
InChI InChI=1S/C17H14F6N2O2/c1-25(15(26)27-14(16(18,19)20)17(21,22)23)10-11-3-2-4-13(9-11)12-5-7-24-8-6-12/h2-9,14H,10H2,1H3
InChIKey RBZKWMMBPOHSDF-UHFFFAOYSA-N
Molecular Weight 392.301 g/mol
SMILES C(N(Cc1cc(ccc1)-c1ccncc1)C)(=O)OC(C(F)(F)F)C(F)(F)F
SPLASH splash10-014m-2910000000-5511714478da8069a6b9
Source of Spectrum SWG-33-3295-0
Wiley ID 1810153