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2-[5-(4-acetylphenoxy)-3-nitro-1H-1,2,4-triazol-1-yl]acetamide
SpectraBase Compound ID H72uwQWd3n7
InChI InChI=1S/C12H11N5O5/c1-7(18)8-2-4-9(5-3-8)22-12-14-11(17(20)21)15-16(12)6-10(13)19/h2-5H,6H2,1H3,(H2,13,19)
InChIKey YCMGPCZBTRSGAL-UHFFFAOYSA-N
Mol Weight 305.25 g/mol
Molecular Formula C12H11N5O5
Exact Mass 305.076018 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CgaoJbtTUzK
Name 2-[5-(4-acetylphenoxy)-3-nitro-1H-1,2,4-triazol-1-yl]acetamide
Alternate Name(s) 2-[5-(4-ethanoylphenoxy)-3-nitro-1,2,4-triazol-1-yl]ethanamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H11N5O5
InChI InChI=1S/C12H11N5O5/c1-7(18)8-2-4-9(5-3-8)22-12-14-11(17(20)21)15-16(12)6-10(13)19/h2-5H,6H2,1H3,(H2,13,19)
InChIKey YCMGPCZBTRSGAL-UHFFFAOYSA-N
Molecular Weight 305.250 g/mol
SMILES NC(C[n]1nc(N(=O)=O)nc1Oc1ccc(cc1)C(=O)C)=O
SPLASH splash10-0006-9220000000-ecc20d4cc4d559697e06
Source of Spectrum IY-2-5144-3
Wiley ID 1659426