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PCYITTWLZZCVKM-UHFFFAOYSA-N
SpectraBase Compound ID KBz9cnzyllQ
InChI InChI=1S/C6H5BrN2O3/c7-3-5(10)4-1-2-6(8-4)9(11)12/h1-2,8H,3H2
InChIKey PCYITTWLZZCVKM-UHFFFAOYSA-N
Mol Weight 233.02 g/mol
Molecular Formula C6H5BrN2O3
Exact Mass 231.948355 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AdULf3wQ2Cp
Name 2-Bromanyl-1-(5-nitro-1H-pyrrol-2-yl)ethanone
Alternate Name(s) 2-Bromo-1-(5-nitro-1H-pyrrol-2-yl)ethanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C6H5BrN2O3
InChI InChI=1S/C6H5BrN2O3/c7-3-5(10)4-1-2-6(8-4)9(11)12/h1-2,8H,3H2
InChIKey PCYITTWLZZCVKM-UHFFFAOYSA-N
Molecular Weight 233.021 g/mol
SMILES [nH]1c(ccc1N(=O)=O)C(=O)CBr
SPLASH splash10-000i-0910000000-670c05a874190be9d35e
Source of Spectrum KC-0-251-7
Wiley ID 827388