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1,1-Dimethyl-2-[4-nitro-3-(trifluoromethyl)anilino]-2-oxoethyl butyrate
SpectraBase Compound ID 5U1zuGCkI3T
InChI InChI=1S/C15H17F3N2O5/c1-4-5-12(21)25-14(2,3)13(22)19-9-6-7-11(20(23)24)10(8-9)15(16,17)18/h6-8H,4-5H2,1-3H3,(H,19,22)
InChIKey MOORDEJKDBUEKM-UHFFFAOYSA-N
Mol Weight 362.31 g/mol
Molecular Formula C15H17F3N2O5
Exact Mass 362.108956 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FyH3Xu9wPbr
Name 1,1-Dimethyl-2-[4-nitro-3-(trifluoromethyl)anilino]-2-oxoethyl butyrate
CAS Registry Number 110990-15-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H17F3N2O5
InChI InChI=1S/C15H17F3N2O5/c1-4-5-12(21)25-14(2,3)13(22)19-9-6-7-11(20(23)24)10(8-9)15(16,17)18/h6-8H,4-5H2,1-3H3,(H,19,22)
InChIKey MOORDEJKDBUEKM-UHFFFAOYSA-N
Molecular Weight 362.305 g/mol
SMILES N(C(C(OC(=O)CCC)(C)C)=O)c1cc(C(F)(F)F)c(N(=O)=O)cc1
SPLASH splash10-00dl-9100000000-0505d07c4e4eb1a9bb31
Source of Spectrum AD-0-2532-0
Synonyms Propanamide, 2-methyl-2-(1-oxobutoxy)-N-(3-trifluoromethyl-4-nitrophenyl)- Butanoic acid [2-methyl-1-[4-nitro-3-(trifluoromethyl)anilino]-1-oxopropan-2-yl] ester [2-methyl-1-[4-nitro-3-(trifluoromethyl)anilino]-1-oxopropan-2-yl] butanoate [1,1-dimethyl-2-[4-nitro-3-(trifluoromethyl)anilino]-2-oxo-ethyl] butanoate [2-methyl-1-[[4-nitro-3-(trifluoromethyl)phenyl]amino]-1-oxidanylidene-propan-2-yl] butanoate
Wiley ID 1420509