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1-[4-(5-Methyl-[1,3,4]oxadiazol-2-yl)-2-nitro-phenyl]-azepane
SpectraBase Compound ID 7vAEBgpZdiS
InChI InChI=1S/C15H18N4O3/c1-11-16-17-15(22-11)12-6-7-13(14(10-12)19(20)21)18-8-4-2-3-5-9-18/h6-7,10H,2-5,8-9H2,1H3
InChIKey CNFIWKHYEQOXPV-UHFFFAOYSA-N
Mol Weight 302.33 g/mol
Molecular Formula C15H18N4O3
Exact Mass 302.13789 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LucOn7zkerP
Name 1-[4-(5-Methyl-[1,3,4]oxadiazol-2-yl)-2-nitro-phenyl]-azepane
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H18N4O3
InChI InChI=1S/C15H18N4O3/c1-11-16-17-15(22-11)12-6-7-13(14(10-12)19(20)21)18-8-4-2-3-5-9-18/h6-7,10H,2-5,8-9H2,1H3
InChIKey CNFIWKHYEQOXPV-UHFFFAOYSA-N
Molecular Weight 302.334 g/mol
SMILES c1(N(=O)=O)c(N2CCCCCC2)ccc(-c2nnc(o2)C)c1
SPLASH splash10-000i-2790000000-cb8cda34cfe53fd558da
Synonyms 2-[4-(1-azepanyl)-3-nitrophenyl]-5-methyl-1,3,4-oxadiazole 2-[4-(azepan-1-yl)-3-nitro-phenyl]-5-methyl-1,3,4-oxadiazole
Wiley ID 1461872