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2-(3-azidopropyl)-2-(2-oxopropyl)cyclohexane-1,3-dione
SpectraBase Compound ID Djs0XQVliwD
InChI InChI=1S/C12H17N3O3/c1-9(16)8-12(6-3-7-14-15-13)10(17)4-2-5-11(12)18/h2-8H2,1H3
InChIKey COVMPFXUFLKMJT-UHFFFAOYSA-N
Mol Weight 251.29 g/mol
Molecular Formula C12H17N3O3
Exact Mass 251.126991 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2OB4mKPsSpo
Name 2-(3-azidopropyl)-2-(2-oxopropyl)cyclohexane-1,3-dione
Appearance Green oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 251.126991416 u
Formula C12H17N3O3
InChI InChI=1S/C12H17N3O3/c1-9(16)8-12(6-3-7-14-15-13)10(17)4-2-5-11(12)18/h2-8H2,1H3
InChIKey COVMPFXUFLKMJT-UHFFFAOYSA-N
Instrument Name Shimadzu GCMSQP2010SE
Ionization Type EI
Literature Reference DOI 10.1002/anie.202107909
Molecular Weight 251.286 g/mol
Quality 244
SMILES C1(C(C(CCC1)=O)(CCCN=[N+]=[N-])CC(C)=O)=O
SPLASH splash10-05ci-9500000000-52378337ace5ac24716c
Source of Spectrum ACI-60-SM38-1p (DOI: 10.1002/anie.202107909)
Wiley ID 1891349