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Ethyl 4-nitro-3-[3-(trifluoromethyl)phenyl]butanoate
SpectraBase Compound ID CznbLOhAPpe
InChI InChI=1S/C13H14F3NO4/c1-2-21-12(18)7-10(8-17(19)20)9-4-3-5-11(6-9)13(14,15)16/h3-6,10H,2,7-8H2,1H3
InChIKey JCYMLNAXAMHMCK-UHFFFAOYSA-N
Mol Weight 305.25 g/mol
Molecular Formula C13H14F3NO4
Exact Mass 305.087492 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1uP1aGmGjQ
Name Ethyl 4-nitro-3-[3-(trifluoromethyl)phenyl]butanoate
Alternate Name(s) 4-Nitro-3-[3-(trifluoromethyl)phenyl]butanoic acid ethyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H14F3NO4
InChI InChI=1S/C13H14F3NO4/c1-2-21-12(18)7-10(8-17(19)20)9-4-3-5-11(6-9)13(14,15)16/h3-6,10H,2,7-8H2,1H3
InChIKey JCYMLNAXAMHMCK-UHFFFAOYSA-N
Molecular Weight 305.253 g/mol
SMILES C(N(=O)=O)C(c1cc(C(F)(F)F)ccc1)CC(=O)OCC
SPLASH splash10-01bi-0910000000-eded65b129cfeb57df53
Source of Spectrum F-52-1431-12
Wiley ID 794836