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1-((E)-2-[1-(4-Methoxyphenyl)-1H-tetraazol-5-yl]ethenyl)azepane
SpectraBase Compound ID 7Yyd560juQL
InChI InChI=1S/C16H21N5O/c1-22-15-8-6-14(7-9-15)21-16(17-18-19-21)10-13-20-11-4-2-3-5-12-20/h6-10,13H,2-5,11-12H2,1H3/b13-10+
InChIKey MWJIVYXABMCDKI-JLHYYAGUSA-N
Mol Weight 299.38 g/mol
Molecular Formula C16H21N5O
Exact Mass 299.17461 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID C1NC4mzHB7S
Name 1-((E)-2-[1-(4-Methoxyphenyl)-1H-tetraazol-5-yl]ethenyl)azepane
CAS Registry Number 299461-89-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H21N5O
InChI InChI=1S/C16H21N5O/c1-22-15-8-6-14(7-9-15)21-16(17-18-19-21)10-13-20-11-4-2-3-5-12-20/h6-10,13H,2-5,11-12H2,1H3/b13-10+
InChIKey MWJIVYXABMCDKI-JLHYYAGUSA-N
Molecular Weight 299.378 g/mol
SMILES C1CCN(\C=C\c2[n](nnn2)-c2ccc(OC)cc2)CCC1
SPLASH splash10-007n-9530000000-2de003bbd7ab951e74bc
Source of Spectrum AD-0-2532-0
Synonyms 1-[(E)-2-[1-(4-methoxyphenyl)-1,2,3,4-tetrazol-5-yl]ethenyl]azepane 1-[(E)-2-[1-(4-methoxyphenyl)-5-tetrazolyl]ethenyl]azepane 1-[(E)-2-[1-(4-methoxyphenyl)tetrazol-5-yl]ethenyl]azepane 1-[(E)-2-[1-(4-methoxyphenyl)tetrazol-5-yl]vinyl]azepane Tetrazole, 5-[2-(1-perhydroazepinyl)ethenyl]-1-(4-methoxyphenyl)-
Wiley ID 1430872