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8-Methoxy-7-nitro-bicyclo[4.4.1]undeca-1,3,5,7,9-pentaene
SpectraBase Compound ID 7ZiBb0cpfFE
InChI InChI=1S/C12H11NO3/c1-16-11-7-6-9-4-2-3-5-10(8-9)12(11)13(14)15/h2-7H,8H2,1H3
InChIKey XFDZZSMRAPJPAL-UHFFFAOYSA-N
Mol Weight 217.22 g/mol
Molecular Formula C12H11NO3
Exact Mass 217.073893 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ie8mvqyNVYZ
Name 8-Methoxy-7-nitro-bicyclo[4.4.1]undeca-1,3,5,7,9-pentaene
CAS Registry Number 118684-55-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H11NO3
InChI InChI=1S/C12H11NO3/c1-16-11-7-6-9-4-2-3-5-10(8-9)12(11)13(14)15/h2-7H,8H2,1H3
InChIKey XFDZZSMRAPJPAL-UHFFFAOYSA-N
Molecular Weight 217.224 g/mol
SMILES C1(N(=O)=O)=C2CC(C=CC=C2)=CC=C1OC
SPLASH splash10-004i-0910000000-c852847bce2b6e2279a1
Source of Spectrum K-122-498-0
Wiley ID 1216544