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4-hydroxy-3-methoxymandelonitrile, diacetate

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4-hydroxy-3-methoxymandelonitrile, diacetate
SpectraBase Compound ID BXIn66G4Y0A
InChI InChI=1S/C13H13NO5/c1-8(15)18-11-5-4-10(6-12(11)17-3)13(7-14)19-9(2)16/h4-6,13H,1-3H3
InChIKey OFTPZWDWEKLJDP-UHFFFAOYSA-N
Mol Weight 263.25 g/mol
Molecular Formula C13H13NO5
Exact Mass 263.079373 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID KGPU4iEeQ2e
Name 4-[(acetyloxy)(cyano)methyl]-2-methoxyphenyl acetate
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C13H13NO5/c1-8(15)18-11-5-4-10(6-12(11)17-3)13(7-14)19-9(2)16/h4-6,13H,1-3H3
InChIKey OFTPZWDWEKLJDP-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_16527
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent DMSO-d6
Source File Reference VendorID: 987/00004002; Labnumber: 987/00004002218848; VK_ID: VK-016532
Temperature 318 °C