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5-Bromo-6-(2,6-difluorobenzyl)pyrimidine-2,4(1H,3H)-dione
SpectraBase Compound ID 4wfcGaiRpyG
InChI InChI=1S/C11H7BrF2N2O2/c12-9-8(15-11(18)16-10(9)17)4-5-6(13)2-1-3-7(5)14/h1-3H,4H2,(H2,15,16,17,18)
InChIKey UDZCGKLDZNISRB-UHFFFAOYSA-N
Mol Weight 317.09 g/mol
Molecular Formula C11H7BrF2N2O2
Exact Mass 315.965897 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9BccTx6cJR0
Name 5-Bromo-6-(2,6-difluorobenzyl)pyrimidine-2,4(1H,3H)-dione
Alternate Name(s) 5-bromo-6-[(2,6-difluorophenyl)methyl]-1H-pyrimidine-2,4-dione 6-[[2,6-bis(fluoranyl)phenyl]methyl]-5-bromanyl-1H-pyrimidine-2,4-dione
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H7BrF2N2O2
InChI InChI=1S/C11H7BrF2N2O2/c12-9-8(15-11(18)16-10(9)17)4-5-6(13)2-1-3-7(5)14/h1-3H,4H2,(H2,15,16,17,18)
InChIKey UDZCGKLDZNISRB-UHFFFAOYSA-N
Molecular Weight 317.090 g/mol
SMILES N1C(C(=C(NC1=O)Cc1c(F)cccc1F)Br)=O
SPLASH splash10-00or-0905000000-42109cea3e8e83a56240
Source of Spectrum Y-46-1300-6b
Wiley ID 1666999