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1-[2-Methyl-3-(1H-1-pyrazolyl)propyl]azepane
SpectraBase Compound ID AupEAE8OmH8
InChI InChI=1S/C13H23N3/c1-13(12-16-10-6-7-14-16)11-15-8-4-2-3-5-9-15/h6-7,10,13H,2-5,8-9,11-12H2,1H3
InChIKey AZACPZAFVPWVHX-UHFFFAOYSA-N
Mol Weight 221.35 g/mol
Molecular Formula C13H23N3
Exact Mass 221.189198 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DYagrG9sXCr
Name 1-[2-Methyl-3-(1H-1-pyrazolyl)propyl]azepane
Alternate Name(s) 1-[2-methyl-3-(1H-pyrazol-1-yl)propyl]hexahydro-1H-azepine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H23N3
InChI InChI=1S/C13H23N3/c1-13(12-16-10-6-7-14-16)11-15-8-4-2-3-5-9-15/h6-7,10,13H,2-5,8-9,11-12H2,1H3
InChIKey AZACPZAFVPWVHX-UHFFFAOYSA-N
Molecular Weight 221.348 g/mol
SMILES c1n[n](cc1)CC(CN1CCCCCC1)C
SPLASH splash10-03k9-3930000000-732bce85ab3f6054b533
Source of Spectrum F-55-9814-15
Wiley ID 838752