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(E)-ethyl 3-(4-chlorostyryl)-2-(pyrrolidin-1-yl)-2H-indazole-5-carboxylate
SpectraBase Compound ID KZKPfn0y3iC
InChI InChI=1S/C22H22ClN3O2/c1-2-28-22(27)17-8-11-20-19(15-17)21(26(24-20)25-13-3-4-14-25)12-7-16-5-9-18(23)10-6-16/h5-12,15H,2-4,13-14H2,1H3/b12-7+
InChIKey QHHNCPWTSHSYHK-KPKJPENVSA-N
Mol Weight 395.89 g/mol
Molecular Formula C22H22ClN3O2
Exact Mass 395.140055 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID E8QurLA3QvJ
Name (E)-ethyl 3-(4-chlorostyryl)-2-(pyrrolidin-1-yl)-2H-indazole-5-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H22ClN3O2
InChI InChI=1S/C22H22ClN3O2/c1-2-28-22(27)17-8-11-20-19(15-17)21(26(24-20)25-13-3-4-14-25)12-7-16-5-9-18(23)10-6-16/h5-12,15H,2-4,13-14H2,1H3/b12-7+
InChIKey QHHNCPWTSHSYHK-KPKJPENVSA-N
Molecular Weight 395.890 g/mol
SMILES c1c2n[n](N3CCCC3)c(\C=C\c3ccc(cc3)Cl)c2cc(C(=O)OCC)c1
SPLASH splash10-004i-0129000000-1ad7295ba26519bbd7f4
Source of Spectrum ACI-52-SM-2c
Synonyms Ethyl (E)-3-(4-chlorostyryl)-2-(pyrrolidin-1-yl)-2H-indazole-5-carboxylate
Wiley ID 1781938