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N-[2,6-dinitro-4-(trifluoromethyl)phenyl]-N-propyl-propanamide
SpectraBase Compound ID J1BurO3AvxQ
InChI InChI=1S/C13H14F3N3O5/c1-3-5-17(11(20)4-2)12-9(18(21)22)6-8(13(14,15)16)7-10(12)19(23)24/h6-7H,3-5H2,1-2H3
InChIKey VFTBFWNODJPOJT-UHFFFAOYSA-N
Mol Weight 349.27 g/mol
Molecular Formula C13H14F3N3O5
Exact Mass 349.088555 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3LvgtT2R3vF
Name N-[2,6-dinitro-4-(trifluoromethyl)phenyl]-N-propyl-propanamide
CAS Registry Number 69236-56-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H14F3N3O5
InChI InChI=1S/C13H14F3N3O5/c1-3-5-17(11(20)4-2)12-9(18(21)22)6-8(13(14,15)16)7-10(12)19(23)24/h6-7H,3-5H2,1-2H3
InChIKey VFTBFWNODJPOJT-UHFFFAOYSA-N
Molecular Weight 349.266 g/mol
SMILES c1(c(c(N(=O)=O)cc(C(F)(F)F)c1)N(C(=O)CC)CCC)N(=O)=O
SPLASH splash10-0a4i-9440000000-64196ca2661bf02e1a82
Source of Spectrum KO-6-4-26
Synonyms N-[2,6-dinitro-4-(trifluoromethyl)phenyl]-N-propyl-propionamide
Wiley ID 1341223