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(R)-1-Acetyl-5-(3-chlorophenyl)-3-(5-methyl-1-p-tolyl-1H-1,2,3-triazol-4-yl)-4,5-dihydro-1H-pyrazole
SpectraBase Compound ID CjujivhDC7l
InChI InChI=1S/C21H20ClN5O/c1-13-7-9-18(10-8-13)26-14(2)21(23-25-26)19-12-20(27(24-19)15(3)28)16-5-4-6-17(22)11-16/h4-11,20H,12H2,1-3H3/t20-/m1/s1
InChIKey SPRNFXOPJPVOKM-HXUWFJFHSA-N
Mol Weight 393.88 g/mol
Molecular Formula C21H20ClN5O
Exact Mass 393.135638 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9cBildz5hFk
Name (R)-1-Acetyl-5-(3-chlorophenyl)-3-(5-methyl-1-p-tolyl-1H-1,2,3-triazol-4-yl)-4,5-dihydro-1H-pyrazole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H20ClN5O
InChI InChI=1S/C21H20ClN5O/c1-13-7-9-18(10-8-13)26-14(2)21(23-25-26)19-12-20(27(24-19)15(3)28)16-5-4-6-17(22)11-16/h4-11,20H,12H2,1-3H3/t20-/m1/s1
InChIKey SPRNFXOPJPVOKM-HXUWFJFHSA-N
Molecular Weight 393.878 g/mol
SMILES c1(C2=NN(C(=O)C)[C@](C2)(c2cc(Cl)ccc2)[H])nn[n](c1C)-c1ccc(cc1)C
SPLASH splash10-0006-9000000000-b2f123fec6f273985f55
Source of Spectrum Y-49-151-6c
Wiley ID 1706610