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1-(3-Chlorophenyl)-3,6-dicarbethoxy-1,8a-dihydro-1,2,4-triazolo[4,3-a]pyridine
SpectraBase Compound ID B1QALL6qQQq
InChI InChI=1S/C18H18ClN3O4/c1-3-25-17(23)12-8-9-15-21(11-12)16(18(24)26-4-2)20-22(15)14-7-5-6-13(19)10-14/h5-11,15H,3-4H2,1-2H3
InChIKey ZKYNKIKHEUGNMR-UHFFFAOYSA-N
Mol Weight 375.81 g/mol
Molecular Formula C18H18ClN3O4
Exact Mass 375.098584 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EioBs6jlFHg
Name 1-(3-Chlorophenyl)-3,6-dicarbethoxy-1,8a-dihydro-1,2,4-triazolo[4,3-a]pyridine
Alternate Name(s) 1-(3-Chlorophenyl)-8aH-[1,2,4]triazolo[4,3-a]pyridine-3,6-dicarboxylic acid diethyl ester Diethyl 1-(3-chlorophenyl)-1,8a-dihydro[1,2,4]triazolo[4,3-a]pyridine-3,6-dicarboxylate Diethyl 1-(3-chlorophenyl)-8aH-[1,2,4]triazolo[4,3-a]pyridine-3,6-dicarboxylate
CAS Registry Number 142397-10-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H18ClN3O4
InChI InChI=1S/C18H18ClN3O4/c1-3-25-17(23)12-8-9-15-21(11-12)16(18(24)26-4-2)20-22(15)14-7-5-6-13(19)10-14/h5-11,15H,3-4H2,1-2H3
InChIKey ZKYNKIKHEUGNMR-UHFFFAOYSA-N
Molecular Weight 375.812 g/mol
SMILES C12C=CC(=CN2C(=NN1c1cc(ccc1)Cl)C(=O)OCC)C(=O)OCC
SPLASH splash10-004i-0902000000-5130ca5b99e5a28826a4
Source of Spectrum U-1992-890-3
Wiley ID 764458