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1-Carbethoxy-3-phenyl-1,2,4-triazole
SpectraBase Compound ID DndIzIjJuPX
InChI InChI=1S/C11H11N3O2/c1-2-16-11(15)14-8-12-10(13-14)9-6-4-3-5-7-9/h3-8H,2H2,1H3
InChIKey MDUWLFFHTMOCDX-UHFFFAOYSA-N
Mol Weight 217.23 g/mol
Molecular Formula C11H11N3O2
Exact Mass 217.085127 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EcuxB1TUEks
Name 1-Carbethoxy-3-phenyl-1,2,4-triazole
Alternate Name(s) Ethyl 3-phenyl-1H-1,2,4-triazole-1-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H11N3O2
InChI InChI=1S/C11H11N3O2/c1-2-16-11(15)14-8-12-10(13-14)9-6-4-3-5-7-9/h3-8H,2H2,1H3
InChIKey MDUWLFFHTMOCDX-UHFFFAOYSA-N
Literature Reference DOI 10.1002/hlca.19740570514
Molecular Weight 217.228 g/mol
SMILES c1(n[n](cn1)C(OCC)=O)-c1ccccc1
SPLASH splash10-0fr2-1920000000-4a98ef0c671828398d29
Source of Spectrum H-57-1391-8d
Wiley ID 1797222