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2-{2'-[1"-(2'''-<t-Butoxycarbonylamino>-3'"-methylbutanoyl)pyrrolidin-2"-ylcarbonylamino)-1'-(trifluoromethyl)ethylamino]-4-methyl-N,N-dimethylpentanamide
SpectraBase Compound ID H8wQSwwBbET
InChI InChI=1S/C26H46F3N5O5/c1-15(2)13-17(22(36)33(8)9)31-19(26(27,28)29)14-30-21(35)18-11-10-12-34(18)23(37)20(16(3)4)32-24(38)39-25(5,6)7/h15-20,31H,10-14H2,1-9H3,(H,30,35)(H,32,38)
InChIKey GVTNUXIDSBAHNV-UHFFFAOYSA-N
Mol Weight 565.7 g/mol
Molecular Formula C26H46F3N5O5
Exact Mass 565.345104 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CgLx8XjY4tf
Name 2-{2'-[1"-(2'''--3'"-methylbutanoyl)pyrrolidin-2"-ylcarbonylamino)-1'-(trifluoromethyl)ethylamino]-4-methyl-N,N-dimethylpentanamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H46F3N5O5
InChI InChI=1S/C26H46F3N5O5/c1-15(2)13-17(22(36)33(8)9)31-19(26(27,28)29)14-30-21(35)18-11-10-12-34(18)23(37)20(16(3)4)32-24(38)39-25(5,6)7/h15-20,31H,10-14H2,1-9H3,(H,30,35)(H,32,38)
InChIKey GVTNUXIDSBAHNV-UHFFFAOYSA-N
Molecular Weight 565.679 g/mol
SMILES N(C(OC(C)(C)C)=O)C(C(N1C(C(NCC(C(F)(F)F)NC(C(N(C)C)=O)CC(C)C)=O)CCC1)=O)C(C)C
SPLASH splash10-05fr-9010000000-6953439e422108f93c42
Source of Spectrum F5-7-2294-19
Wiley ID 1696551