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2-[2'-(1"-<Butoxycarbonyl>pyrrolidin-2"-ylcarbonylamino)-1'-(trifluoromethyl)ethylamino]-4-methyl-N,N-dimethylpentanamide
SpectraBase Compound ID K1bcn5U3Sb
InChI InChI=1S/C21H37F3N4O4/c1-13(2)11-14(18(30)27(6)7)26-16(21(22,23)24)12-25-17(29)15-9-8-10-28(15)19(31)32-20(3,4)5/h13-16,26H,8-12H2,1-7H3,(H,25,29)
InChIKey KHQMQBSZWMWDIR-UHFFFAOYSA-N
Mol Weight 466.5 g/mol
Molecular Formula C21H37F3N4O4
Exact Mass 466.27669 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 99dVqILrTDd
Name 2-[2'-(1"-pyrrolidin-2"-ylcarbonylamino)-1'-(trifluoromethyl)ethylamino]-4-methyl-N,N-dimethylpentanamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H37F3N4O4
InChI InChI=1S/C21H37F3N4O4/c1-13(2)11-14(18(30)27(6)7)26-16(21(22,23)24)12-25-17(29)15-9-8-10-28(15)19(31)32-20(3,4)5/h13-16,26H,8-12H2,1-7H3,(H,25,29)
InChIKey KHQMQBSZWMWDIR-UHFFFAOYSA-N
Molecular Weight 466.546 g/mol
SMILES N(C(C1N(C(OC(C)(C)C)=O)CCC1)=O)CC(C(F)(F)F)NC(C(N(C)C)=O)CC(C)C
SPLASH splash10-0603-9021100000-ee18d24f237354bef7e1
Source of Spectrum F5-7-2294-18
Wiley ID 1696552