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Mandelonitrile

View entire compound with spectra: 5 NMR, 2 FTIR, 1 Raman, 6 MS (GC), and 2 Near IR

Mandelonitrile
SpectraBase Compound ID BRdUEqia95p
InChI InChI=1S/C8H7NO/c9-6-8(10)7-4-2-1-3-5-7/h1-5,8,10H
InChIKey NNICRUQPODTGRU-UHFFFAOYSA-N
Mol Weight 133.15 g/mol
Molecular Formula C8H7NO
Exact Mass 133.052764 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 8Bv2uJRn9dE
Name Mandelonitrile
Source of Sample Sigma-Aldrich Co. LLC.
Catalog Number 116025
CAS Registry Number 532-28-5
Copyright Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H7NO
InChI InChI=1S/C8H7NO/c9-6-8(10)7-4-2-1-3-5-7/h1-5,8,10H
InChIKey NNICRUQPODTGRU-UHFFFAOYSA-N
Observed nucleus 13C
Purity Tech.
Solvent CDCl3
Source of Spectrum Sigma-Aldrich Co. LLC.
Synonyms alpha-Hydroxyphenylacetonitrile Benzaldehyde cyanohydrin Mandelic acid nitrile
Wiley ID SIAL_13CNMR_000473