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2-Butoxy-N-(3-chloro-4-fluorophenyl)-5-fluoropyrimidin-4-amine
SpectraBase Compound ID 6sGSrU1nwYj
InChI InChI=1S/C14H14ClF2N3O/c1-2-3-6-21-14-18-8-12(17)13(20-14)19-9-4-5-11(16)10(15)7-9/h4-5,7-8H,2-3,6H2,1H3,(H,18,19,20)
InChIKey HALKPOQKUSPNLH-UHFFFAOYSA-N
Mol Weight 313.74 g/mol
Molecular Formula C14H14ClF2N3O
Exact Mass 313.079346 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DLQeIJJs7yx
Name 2-Butoxy-N-(3-chloro-4-fluorophenyl)-5-fluoropyrimidin-4-amine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H14ClF2N3O
InChI InChI=1S/C14H14ClF2N3O/c1-2-3-6-21-14-18-8-12(17)13(20-14)19-9-4-5-11(16)10(15)7-9/h4-5,7-8H,2-3,6H2,1H3,(H,18,19,20)
InChIKey HALKPOQKUSPNLH-UHFFFAOYSA-N
Literature Reference DOI 10.5012/bkcs.2013.34.5.1349
Molecular Weight 313.736 g/mol
SMILES N(c1nc(ncc1F)OCCCC)c1cc(c(cc1)F)Cl
SPLASH splash10-0a4i-0292000000-bc79511ed292e194c8ef
Source of Spectrum QB-34-1351-6i
Wiley ID 1743530