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Allyl 4-(2-iodophenyl)-1,6-dimethyl-2-oxo-1,2,3,4-tetrahydro-5-pyrimidinecarboxylate
SpectraBase Compound ID 2u8D3Rmigrf
InChI InChI=1S/C16H17IN2O3/c1-4-9-22-15(20)13-10(2)19(3)16(21)18-14(13)11-7-5-6-8-12(11)17/h4-8,14H,1,9H2,2-3H3,(H,18,21)
InChIKey VKJKBANGSXOKTN-UHFFFAOYSA-N
Mol Weight 412.23 g/mol
Molecular Formula C16H17IN2O3
Exact Mass 412.028387 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1BCf6MSG4ge
Name Allyl 4-(2-iodophenyl)-1,6-dimethyl-2-oxo-1,2,3,4-tetrahydro-5-pyrimidinecarboxylate
Alternate Name(s) 4-(2-Iodo-phenyl)-1,6-dimethyl-2-oxo-1,2,3,4-tetrahydro-pyrimidine-5-carboxylic acid allyl ester 6-(2-iodophenyl)-2-keto-3,4-dimethyl-1,6-dihydropyrimidine-5-carboxylic acid allyl ester 6-(2-iodophenyl)-3,4-dimethyl-2-oxo-1,6-dihydropyrimidine-5-carboxylic acid prop-2-enyl ester Allyl 6-(2-iodophenyl)-3,4-dimethyl-2-oxo-1,6-dihydropyrimidine-5-carboxylate Prop-2-enyl 6-(2-iodanylphenyl)-3,4-dimethyl-2-oxidanylidene-1,6-dihydropyrimidine-5-carboxylate Prop-2-enyl 6-(2-iodophenyl)-3,4-dimethyl-2-oxo-1,6-dihydropyrimidine-5-carboxylate
CAS Registry Number 314052-78-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H17IN2O3
InChI InChI=1S/C16H17IN2O3/c1-4-9-22-15(20)13-10(2)19(3)16(21)18-14(13)11-7-5-6-8-12(11)17/h4-8,14H,1,9H2,2-3H3,(H,18,21)
InChIKey VKJKBANGSXOKTN-UHFFFAOYSA-N
Molecular Weight 412.227 g/mol
SMILES N1C(N(C(=C(C1c1c(cccc1)I)C(OCC=C)=O)C)C)=O
SPLASH splash10-0a4i-5892000000-42c0419f7b6393eb2837
Wiley ID 1459221