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(R)-5-(3-Chlorophenyl)-3-(5-methyl-1-p-tolyl-1H-1,2,3-triazol-4-yl)-1-propionyl-4,5-dihydro-1H-pyrazole
SpectraBase Compound ID FLGfselPzlP
InChI InChI=1S/C22H22ClN5O/c1-4-21(29)28-20(16-6-5-7-17(23)12-16)13-19(25-28)22-15(3)27(26-24-22)18-10-8-14(2)9-11-18/h5-12,20H,4,13H2,1-3H3/t20-/m1/s1
InChIKey VQEIZQFMYNLRLW-HXUWFJFHSA-N
Mol Weight 407.91 g/mol
Molecular Formula C22H22ClN5O
Exact Mass 407.151288 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1vpMOu34aTB
Name (R)-5-(3-Chlorophenyl)-3-(5-methyl-1-p-tolyl-1H-1,2,3-triazol-4-yl)-1-propionyl-4,5-dihydro-1H-pyrazole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H22ClN5O
InChI InChI=1S/C22H22ClN5O/c1-4-21(29)28-20(16-6-5-7-17(23)12-16)13-19(25-28)22-15(3)27(26-24-22)18-10-8-14(2)9-11-18/h5-12,20H,4,13H2,1-3H3/t20-/m1/s1
InChIKey VQEIZQFMYNLRLW-HXUWFJFHSA-N
Molecular Weight 407.905 g/mol
SMILES c1(C2=NN(C(=O)CC)[C@](C2)(c2cc(Cl)ccc2)[H])nn[n](c1C)-c1ccc(cc1)C
SPLASH splash10-0a4j-9000000000-3292290a8202f58323b5
Source of Spectrum Y-49-151-6d
Wiley ID 1706609