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2-bromo-3-nitrobenzoic acid, methyl ester
SpectraBase Compound ID A5jNRKEjQqS
InChI InChI=1S/C8H6BrNO4/c1-14-8(11)5-3-2-4-6(7(5)9)10(12)13/h2-4H,1H3
InChIKey YUWPKYJCYRFBJT-UHFFFAOYSA-N
Mol Weight 260.04 g/mol
Molecular Formula C8H6BrNO4
Exact Mass 258.948021 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GbrOcvnipzS
Name Methyl 2-bromo-3-nitrobenzoate
Appearance Colourless plates
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H6BrNO4
InChI InChI=1S/C8H6BrNO4/c1-14-8(11)5-3-2-4-6(7(5)9)10(12)13/h2-4H,1H3
InChIKey YUWPKYJCYRFBJT-UHFFFAOYSA-N
Instrument Name VG Micromass 7070F or JEOL JMS-AX505HF
Ionization Type EI
Literature Reference DOI 10.3998/ark.5550190.0005.a15
Molecular Weight 260.043 g/mol
SMILES COC(c1c(c(ccc1)[N+](=O)[O-])Br)=O
SPLASH splash10-004i-3290000000-c09e4512ae5a49d4d737
Source of Spectrum ARK-2004-162-9
Wiley ID 1875852