2,2,3,3,3-Pentafluoropropyl 4-(1,3-benzodioxol-5-yl)-6-methyl-2-oxo-1,2,3,4-tetrahydro-5-pyrimidinecarboxylate

SpectraBase Compound ID	GqDTV4lpZAn
InChI	InChI=1S/C16H13F5N2O5/c1-7-11(13(24)26-5-15(17,18)16(19,20)21)12(23-14(25)22-7)8-2-3-9-10(4-8)28-6-27-9/h2-4,12H,5-6H2,1H3,(H2,22,23,25)
InChIKey	RSYVPPHQGVOZLG-UHFFFAOYSA-N Google Search
Mol Weight	408.28 g/mol
Molecular Formula	C16H13F5N2O5
Exact Mass	408.074462 g/mol

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SpectraBase Spectrum ID	9i5sGhAgD6r
Name	2,2,3,3,3-Pentafluoropropyl 4-(1,3-benzodioxol-5-yl)-6-methyl-2-oxo-1,2,3,4-tetrahydro-5-pyrimidinecarboxylate
Alternate Name(s)	2,2,3,3,3-pentafluoropropyl 4-(1,3-benzodioxol-5-yl)-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate 2,2,3,3,3-pentakis(fluoranyl)propyl 4-(1,3-benzodioxol-5-yl)-6-methyl-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate 4-(1,3-benzodioxol-5-yl)-2-keto-6-methyl-3,4-dihydro-1H-pyrimidine-5-carboxylic acid 2,2,3,3,3-pentafluoropropyl ester 4-(1,3-benzodioxol-5-yl)-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid 2,2,3,3,3-pentafluoropropyl ester Pyrimidine 5-carboxylic acid, 1,2,3,4-tetrahydro-2-oxo-4-(3,4-methylendioxyphenyl)-6-methyl-, 2,2,3,3,3-pentafluoropropyl ester
CAS Registry Number	295344-55-7
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C16H13F5N2O5
InChI	InChI=1S/C16H13F5N2O5/c1-7-11(13(24)26-5-15(17,18)16(19,20)21)12(23-14(25)22-7)8-2-3-9-10(4-8)28-6-27-9/h2-4,12H,5-6H2,1H3,(H2,22,23,25)
InChIKey	RSYVPPHQGVOZLG-UHFFFAOYSA-N
Molecular Weight	408.281 g/mol
SMILES	N1C(NC(=C(C1c1cc2OCOc2cc1)C(OCC(C(F)(F)F)(F)F)=O)C)=O
SPLASH	splash10-0550-4590300000-0330b883480249fe2d8e
Source of Spectrum	AD-0-2532-0
Wiley ID	1421335