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5-(4-Methoxyphenyl)-2H-triazole-4-carboxylic acid ethyl ester
SpectraBase Compound ID AK66Y4YZ0aM
InChI InChI=1S/C12H13N3O3/c1-3-18-12(16)11-10(13-15-14-11)8-4-6-9(17-2)7-5-8/h4-7H,3H2,1-2H3,(H,13,14,15)
InChIKey YCKRCAPXJXGNAT-UHFFFAOYSA-N
Mol Weight 247.25 g/mol
Molecular Formula C12H13N3O3
Exact Mass 247.095691 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 94DlB9QZSco
Name 5-(4-Methoxyphenyl)-2H-triazole-4-carboxylic acid ethyl ester
Alternate Name(s) Ethyl 5-(4-methoxyphenyl)-2H-1,2,3-triazole-4-carboxylate Ethyl 5-(4-methoxyphenyl)-2H-triazole-4-carboxylate
CAS Registry Number 51719-75-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H13N3O3
InChI InChI=1S/C12H13N3O3/c1-3-18-12(16)11-10(13-15-14-11)8-4-6-9(17-2)7-5-8/h4-7H,3H2,1-2H3,(H,13,14,15)
InChIKey YCKRCAPXJXGNAT-UHFFFAOYSA-N
Molecular Weight 247.254 g/mol
SMILES [nH]1nnc(c1-c1ccc(cc1)OC)C(=O)OCC
SPLASH splash10-000j-1950000000-5863ca3b935a281bd7ad
Source of Spectrum KC-1979-16-1
Wiley ID 1249838