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Ethyl 5-chloro-7-isopropylpyrazolo[1,5-a]pyrimidine-6-carboxylate
SpectraBase Compound ID HjlmxBxX7Q7
InChI InChI=1S/C12H14ClN3O2/c1-4-18-12(17)9-10(7(2)3)16-8(5-6-14-16)15-11(9)13/h5-7H,4H2,1-3H3
InChIKey DJGGKUXDJIONIR-UHFFFAOYSA-N
Mol Weight 267.72 g/mol
Molecular Formula C12H14ClN3O2
Exact Mass 267.077454 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FUEztydBS38
Name Ethyl 5-chloro-7-isopropylpyrazolo[1,5-a]pyrimidine-6-carboxylate
Appearance White solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 267.077454401 u
Formula C12H14ClN3O2
GC Column HP 5 (10 m x 0.25 mm, film thickness 0.25 micrometer)
InChI InChI=1S/C12H14ClN3O2/c1-4-18-12(17)9-10(7(2)3)16-8(5-6-14-16)15-11(9)13/h5-7H,4H2,1-3H3
InChIKey DJGGKUXDJIONIR-UHFFFAOYSA-N
Instrument Name Finnigan MAT 95Q or Finnigan MAT 90
Ionization Type EI
Literature Reference DOI 10.1002/chem.202200733
Molecular Weight 267.716 g/mol
Quality 150
Reported Formula C12H14ClN3O2
SMILES C(C)OC(=O)C=1C(=NC=2N(C1C(C)C)N=CC2)Cl
SPLASH splash10-014r-0890000000-c216894649cf0a99fdcb
Source of Spectrum QE-28-SM35-21i (DOI: 10.1002/chem.202200733)
Wiley ID 1900430