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1H-Pyrazole-1-butanoic acid, 4-[[2-(2-fluorophenoxy)acetyl]amino]-
SpectraBase Compound ID 2Tf0lHiatCH
InChI InChI=1S/C15H16FN3O4/c16-12-4-1-2-5-13(12)23-10-14(20)18-11-8-17-19(9-11)7-3-6-15(21)22/h1-2,4-5,8-9H,3,6-7,10H2,(H,18,20)(H,21,22)
InChIKey RSQYUVCMXAITNG-UHFFFAOYSA-N
Mol Weight 321.31 g/mol
Molecular Formula C15H16FN3O4
Exact Mass 321.112484 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID A8MglFLsu9j
Name 1H-Pyrazole-1-butanoic acid, 4-[[2-(2-fluorophenoxy)acetyl]amino]-
Alternate Name(s) 4-[4-[[2-(2-fluorophenoxy)-1-oxoethyl]amino]-1-pyrazolyl]butanoic acid 4-[4-[[2-(2-fluorophenoxy)acetyl]amino]pyrazol-1-yl]butanoic acid 4-[4-[2-(2-fluoranylphenoxy)ethanoylamino]pyrazol-1-yl]butanoic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H16FN3O4
InChI InChI=1S/C15H16FN3O4/c16-12-4-1-2-5-13(12)23-10-14(20)18-11-8-17-19(9-11)7-3-6-15(21)22/h1-2,4-5,8-9H,3,6-7,10H2,(H,18,20)(H,21,22)
InChIKey RSQYUVCMXAITNG-UHFFFAOYSA-N
Molecular Weight 321.308 g/mol
SMILES OC(CCC[n]1cc(cn1)NC(=O)COc1c(F)cccc1)=O
SPLASH splash10-0005-9310000000-2f63484abfe41a5b9318
Source of Spectrum IY-1-4449-2
Wiley ID 1652475