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2,7-Bis(4-nitrobenzyloxy)tropone
SpectraBase Compound ID DaRsYp2k50c
InChI InChI=1S/C21H16N2O7/c24-21-19(29-13-15-5-9-17(10-6-15)22(25)26)3-1-2-4-20(21)30-14-16-7-11-18(12-8-16)23(27)28/h1-12H,13-14H2
InChIKey ZSQGDGCIAMUQEP-UHFFFAOYSA-N
Mol Weight 408.37 g/mol
Molecular Formula C21H16N2O7
Exact Mass 408.095751 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 35u21hacBEf
Name 2,7-Bis(4-nitrobenzyloxy)tropone
Alternate Name(s) 2,7-bis[(4-nitrobenzyl)oxy]-2,4,6-cycloheptatrien-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H16N2O7
InChI InChI=1S/C21H16N2O7/c24-21-19(29-13-15-5-9-17(10-6-15)22(25)26)3-1-2-4-20(21)30-14-16-7-11-18(12-8-16)23(27)28/h1-12H,13-14H2
InChIKey ZSQGDGCIAMUQEP-UHFFFAOYSA-N
Molecular Weight 408.366 g/mol
SMILES c1(N(=O)=O)ccc(COC=2C(C(OCc3ccc(N(=O)=O)cc3)=CC=CC2)=O)cc1
SPLASH splash10-00di-0390100000-5f948597dd8f7d83b8f8
Source of Spectrum AJ-64-3309-5
Wiley ID 1372852