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1-Oxidanidylpyridin-1-ium-2-carbaldehyde

View entire compound with spectra: 3 MS (GC)

1-Oxidanidylpyridin-1-ium-2-carbaldehyde
SpectraBase Compound ID GEvSsKcdOKh
InChI InChI=1S/C6H5NO2/c8-5-6-3-1-2-4-7(6)9/h1-5H
InChIKey PTXWAWIYGFDGMU-UHFFFAOYSA-N
Mol Weight 123.11 g/mol
Molecular Formula C6H5NO2
Exact Mass 123.032028 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KLQSdVP3BGT
Name 1-Oxidanidylpyridin-1-ium-2-carbaldehyde
Alternate Name(s) 1-Oxido-2-pyridin-1-iumcarboxaldehyde 1-Oxidopyridin-1-ium-2-carbaldehyde 2-Pyridinecarbaldehyde 1-oxide 2-Pyridinecarboxaldehyde, N-oxide
CAS Registry Number 7216-40-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C6H5NO2
InChI InChI=1S/C6H5NO2/c8-5-6-3-1-2-4-7(6)9/h1-5H
InChIKey PTXWAWIYGFDGMU-UHFFFAOYSA-N
Molecular Weight 123.111 g/mol
SMILES c1n(c(ccc1)C=O)=O
SPLASH splash10-004i-9100000000-36f2f50d111187c19802
Wiley ID 1479122