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2,2,3,3,4,4,4-heptafluoro-N-(3-(3-methoxyphenyl)butan-2-yl)-N-methylbutanamide
SpectraBase Compound ID CCSsyXraYF
InChI InChI=1S/C16H18F7NO2/c1-9(11-6-5-7-12(8-11)26-4)10(2)24(3)13(25)14(17,18)15(19,20)16(21,22)23/h5-10H,1-4H3
InChIKey GDVNYMHGOHCHRU-UHFFFAOYSA-N
Mol Weight 389.31 g/mol
Molecular Formula C16H18F7NO2
Exact Mass 389.122576 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GbxaJbJoGGR
Name 2,2,3,3,4,4,4-heptafluoro-N-(3-(3-methoxyphenyl)butan-2-yl)-N-methylbutanamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H18F7NO2
InChI InChI=1S/C16H18F7NO2/c1-9(11-6-5-7-12(8-11)26-4)10(2)24(3)13(25)14(17,18)15(19,20)16(21,22)23/h5-10H,1-4H3
InChIKey GDVNYMHGOHCHRU-UHFFFAOYSA-N
Molecular Weight 389.314 g/mol
SMILES c1ccc(cc1C(C(N(C(=O)C(F)(F)C(F)(F)C(F)(F)F)C)C)C)OC
SPLASH splash10-0udi-3290000000-6d783e51109046b0a800
Source of Spectrum Professor Randall Clark, Department: Drug Discovery and Development, Auburn University, Harrison School of Pharmacy, 3306 Walker Building, Auburn, AL 36849
Wiley ID 1815594