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7-[chloranyl-bis(fluoranyl)methyl]-5-(furan-2-yl)pyrazolo[1,5-a]pyrimidine-2-carboxylic acid
SpectraBase Compound ID FaFvOAulsWg
InChI InChI=1S/C12H6ClF2N3O3/c13-12(14,15)9-4-6(8-2-1-3-21-8)16-10-5-7(11(19)20)17-18(9)10/h1-5H,(H,19,20)
InChIKey DSFXDZJPPPJPOL-UHFFFAOYSA-N
Mol Weight 313.65 g/mol
Molecular Formula C12H6ClF2N3O3
Exact Mass 313.006575 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID jt5JUVPxA
Name 7-[chloranyl-bis(fluoranyl)methyl]-5-(furan-2-yl)pyrazolo[1,5-a]pyrimidine-2-carboxylic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H6ClF2N3O3
InChI InChI=1S/C12H6ClF2N3O3/c13-12(14,15)9-4-6(8-2-1-3-21-8)16-10-5-7(11(19)20)17-18(9)10/h1-5H,(H,19,20)
InChIKey DSFXDZJPPPJPOL-UHFFFAOYSA-N
Molecular Weight 313.648 g/mol
SMILES OC(c1n[n]2C(=CC(=Nc2c1)c1occc1)C(Cl)(F)F)=O
SPLASH splash10-03ds-9311000000-2385b3ebcf3fc7c3f085
Synonyms 7-[chloro(difluoro)methyl]-5-(2-furanyl)-2-pyrazolo[1,5-a]pyrimidinecarboxylic acid 7-[chloro(difluoro)methyl]-5-(2-furyl)pyrazolo[1,5-a]pyrimidine-2-carboxylic acid
Wiley ID 1452685