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Methyl 4-formylbenzoate

View entire compound with spectra: 7 NMR, 7 FTIR, 3 Raman, and 10 MS (GC)

Methyl 4-formylbenzoate
SpectraBase Compound ID 6bpJZLSxFl1
InChI InChI=1S/C9H8O3/c1-12-9(11)8-4-2-7(6-10)3-5-8/h2-6H,1H3
InChIKey FEIOASZZURHTHB-UHFFFAOYSA-N
Mol Weight 164.16 g/mol
Molecular Formula C9H8O3
Exact Mass 164.047344 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8jDPc6dQcTb
Name Methyl 4-formylbenzoate
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 164.047344115 u
Formula C9H8O3
InChI InChI=1S/C9H8O3/c1-12-9(11)8-4-2-7(6-10)3-5-8/h2-6H,1H3
InChIKey FEIOASZZURHTHB-UHFFFAOYSA-N
Instrument Name GCMS
Ionization Type EI
Literature Reference DOI 10.1002/chem.201600387
Molecular Weight 164.160 g/mol
Quality 310
SMILES COC(C1=CC=C(C=C1)C=O)=O
SPLASH splash10-03e9-1900000000-8f5483fa2c3f5819985e
Source of Spectrum QE-22-SM3-3-3 (DOI: 10.1002/chem.201600387)
Wiley ID 1903147