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1-(2-Methoxy-5-methyl-benzyl)-3-nitro-1H-[1,2,4]triazole
SpectraBase Compound ID E705xuhLD4Y
InChI InChI=1S/C11H12N4O3/c1-8-3-4-10(18-2)9(5-8)6-14-7-12-11(13-14)15(16)17/h3-5,7H,6H2,1-2H3
InChIKey VIRQRAPQBMCEKV-UHFFFAOYSA-N
Mol Weight 248.24 g/mol
Molecular Formula C11H12N4O3
Exact Mass 248.09094 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5pXE1ogzF1H
Name 1-(2-Methoxy-5-methyl-benzyl)-3-nitro-1H-[1,2,4]triazole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H12N4O3
InChI InChI=1S/C11H12N4O3/c1-8-3-4-10(18-2)9(5-8)6-14-7-12-11(13-14)15(16)17/h3-5,7H,6H2,1-2H3
InChIKey VIRQRAPQBMCEKV-UHFFFAOYSA-N
Molecular Weight 248.242 g/mol
SMILES c1(nc[n](n1)Cc1c(ccc(c1)C)OC)N(=O)=O
SPLASH splash10-056d-9820000000-771c59ba3d92a8377fb3
Synonyms 1-(2-Methoxy-5-methyl-benzyl)-3-nitro-1,2,4-triazole 1-[(2-methoxy-5-methyl-phenyl)methyl]-3-nitro-1,2,4-triazole
Wiley ID 1466342