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6-Nitrospiro[chromane-4,1'-cyclohexan]-2-one
SpectraBase Compound ID 4JuOgTodpiA
InChI InChI=1S/C14H15NO4/c16-13-9-14(6-2-1-3-7-14)11-8-10(15(17)18)4-5-12(11)19-13/h4-5,8H,1-3,6-7,9H2
InChIKey QFEADYTYTAJJIN-UHFFFAOYSA-N
Mol Weight 261.28 g/mol
Molecular Formula C14H15NO4
Exact Mass 261.100108 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1JtSgb9EWk4
Name 6-Nitrospiro[chromane-4,1'-cyclohexan]-2-one
Appearance White solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H15NO4
InChI InChI=1S/C14H15NO4/c16-13-9-14(6-2-1-3-7-14)11-8-10(15(17)18)4-5-12(11)19-13/h4-5,8H,1-3,6-7,9H2
InChIKey QFEADYTYTAJJIN-UHFFFAOYSA-N
Instrument Name Waters GCT Premier
Ionization Type EI Positive ion
Literature Reference DOI 10.1021/acs.joc.1c01887
Molecular Weight 261.277 g/mol
SMILES c1(cc2c(cc1)OC(CC21CCCCC1)=O)[N+]([O-])=O
SPLASH splash10-0bt9-1590000000-58040e4f136a2783d25a
Source of Spectrum JOC-87-SM71-8f
Wiley ID 1884181