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3-(5-Bromopyridin-3-yl)propanal
SpectraBase Compound ID 9uR5SSs4b5X
InChI InChI=1S/C8H8BrNO/c9-8-4-7(2-1-3-11)5-10-6-8/h3-6H,1-2H2
InChIKey WXEDZYSMCGDQRG-UHFFFAOYSA-N
Mol Weight 214.06 g/mol
Molecular Formula C8H8BrNO
Exact Mass 212.978927 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CehzcFsiZk3
Name 3-(5-Bromopyridin-3-yl)propanal
Appearance Orange oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 212.978926881 u
Formula C8H8BrNO
InChI InChI=1S/C8H8BrNO/c9-8-4-7(2-1-3-11)5-10-6-8/h3-6H,1-2H2
InChIKey WXEDZYSMCGDQRG-UHFFFAOYSA-N
Instrument Name Finnigan MAT 8200
Ionization Type EI
Literature Reference DOI 10.1002/anie.202209651
Molecular Weight 214.062 g/mol
Quality 273
Reported Formula C8H8NOBr
SMILES C=1(Br)C=C(C=NC1)CCC=O
SPLASH splash10-0far-2900000000-f5de536f57f940858a0d
Source of Spectrum ACI-61-SM4-S1 (DOI: 10.1002/anie.202209651)
Wiley ID 1899511