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8-(4-chloro-2-nitro-phenyl)-1,4-dioxa-8-azaspiro[4.5]decane
SpectraBase Compound ID 990WJZbQGXM
InChI InChI=1S/C13H15ClN2O4/c14-10-1-2-11(12(9-10)16(17)18)15-5-3-13(4-6-15)19-7-8-20-13/h1-2,9H,3-8H2
InChIKey HEHIVKUJLQHVOD-UHFFFAOYSA-N
Mol Weight 298.73 g/mol
Molecular Formula C13H15ClN2O4
Exact Mass 298.072035 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JeWWnhdV0o2
Name 8-(4-chloro-2-nitro-phenyl)-1,4-dioxa-8-azaspiro[4.5]decane
Appearance Dark orange solid
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Formula C13H15ClN2O4
InChI InChI=1S/C13H15ClN2O4/c14-10-1-2-11(12(9-10)16(17)18)15-5-3-13(4-6-15)19-7-8-20-13/h1-2,9H,3-8H2
InChIKey HEHIVKUJLQHVOD-UHFFFAOYSA-N
Instrument Name Varian GCMS Saturn 2100 T
Ionization Type EI
Literature Reference DOI 10.1002/anie.201812068
Molecular Weight 298.726 g/mol
Reported Formula C13H16ClN2O4
SMILES c1c(c(ccc1Cl)N1CCC2(CC1)OCCO2)[N+]([O-])=O
SPLASH splash10-0002-7690000000-1ddfc8c183e0460a4d32
Source of Spectrum ACI-58-SM19-3df
Wiley ID 1840444