Butanoic acid, 2,2,3,3,4,4,4-heptafluoro-, 3-[hexahydro-1,3-dimethyl-2,4,6-trioxo-5-(2-propenyl)-5-pyrimidinyl]-1,3-dimethylpropyl ester

SpectraBase Compound ID	LL13vRa7Bf3
InChI	InChI=1S/C18H21F7N2O5/c1-6-7-15(11(28)26(4)14(31)27(5)12(15)29)9(2)8-10(3)32-13(30)16(19,20)17(21,22)18(23,24)25/h6,9-10H,1,7-8H2,2-5H3
InChIKey	DOMOJXYDOWCKDI-UHFFFAOYSA-N Google Search
Mol Weight	478.36 g/mol
Molecular Formula	C18H21F7N2O5
Exact Mass	478.133869 g/mol

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SpectraBase Spectrum ID	1haf6AlT0uc
Name	Butanoic acid, 2,2,3,3,4,4,4-heptafluoro-, 3-[hexahydro-1,3-dimethyl-2,4,6-trioxo-5-(2-propenyl)-5-pyrimidinyl]-1,3-dimethylpropyl ester
CAS Registry Number	55429-89-5
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C18H21F7N2O5
InChI	InChI=1S/C18H21F7N2O5/c1-6-7-15(11(28)26(4)14(31)27(5)12(15)29)9(2)8-10(3)32-13(30)16(19,20)17(21,22)18(23,24)25/h6,9-10H,1,7-8H2,2-5H3
InChIKey	DOMOJXYDOWCKDI-UHFFFAOYSA-N
Molecular Weight	478.364 g/mol
SMILES	C(C(C)C1(CC=C)C(=O)N(C)C(N(C1=O)C)=O)C(OC(C(C(C(F)(F)F)(F)F)(F)F)=O)C
SPLASH	splash10-0002-3920000000-31ea3e9cb15bc0df3e1b
Source of Spectrum	BA-0-170-0
Synonyms	3-(5-Allyl-1,3-dimethyl-2,4,6-trioxohexahydro-5-pyrimidinyl)-1-methylbutyl 2,2,3,3,4,4,4-heptafluorobutanoate 2,2,3,3,4,4,4-heptafluorobutanoic acid 4-(1,3-dimethyl-2,4,6-trioxo-5-prop-2-enyl-1,3-diazinan-5-yl)pentan-2-yl ester 4-(1,3-dimethyl-2,4,6-trioxo-5-prop-2-enyl-1,3-diazinan-5-yl)pentan-2-yl 2,2,3,3,4,4,4-heptafluorobutanoate 4-[1,3-dimethyl-2,4,6-tris(oxidanylidene)-5-prop-2-enyl-1,3-diazinan-5-yl]pentan-2-yl 2,2,3,3,4,4,4-heptakis(fluoranyl)butanoate [3-(5-allyl-1,3-dimethyl-2,4,6-trioxo-hexahydropyrimidin-5-yl)-1-methyl-butyl] 2,2,3,3,4,4,4-heptafluorobutanoate
Wiley ID	62138