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3-(4-Nitrobenzyl)tropolone

View entire compound with spectra: 1 MS (GC)

3-(4-Nitrobenzyl)tropolone
SpectraBase Compound ID DH1wtnDEnok
InChI InChI=1S/C14H11NO4/c16-13-4-2-1-3-11(14(13)17)9-10-5-7-12(8-6-10)15(18)19/h1-8H,9H2,(H,16,17)
InChIKey QEWMKMWSHRWWCF-UHFFFAOYSA-N
Mol Weight 257.24 g/mol
Molecular Formula C14H11NO4
Exact Mass 257.068808 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 61am8ZJGRtg
Name 3-(4-Nitrobenzyl)tropolone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H11NO4
InChI InChI=1S/C14H11NO4/c16-13-4-2-1-3-11(14(13)17)9-10-5-7-12(8-6-10)15(18)19/h1-8H,9H2,(H,16,17)
InChIKey QEWMKMWSHRWWCF-UHFFFAOYSA-N
Ionization Type EI-B
Molecular Weight 257.245 g/mol
SMILES OC1=C(Cc2ccc([N+]([O-])=O)cc2)C=CC=CC1=O
SPLASH splash10-0le9-3920000000-27020ca5d348bd5b5a8a
Source of Spectrum SRH-2022-10984-0
Wiley ID 1832593