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(R)-2-Hydroxy-2-(3-acetyloxymethyl-4-acetyloxyphenyl)acetonitrile
SpectraBase Compound ID 8XHO41Y1f7h
InChI InChI=1S/C13H13NO5/c1-8(15)18-7-11-5-10(12(17)6-14)3-4-13(11)19-9(2)16/h3-5,12,17H,7H2,1-2H3/t12-/m0/s1
InChIKey JIFNEOJQBFJXOP-LBPRGKRZSA-N
Mol Weight 263.25 g/mol
Molecular Formula C13H13NO5
Exact Mass 263.079373 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JnhH9bUu6hK
Name (R)-2-Hydroxy-2-(3-acetyloxymethyl-4-acetyloxyphenyl)acetonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H13NO5
InChI InChI=1S/C13H13NO5/c1-8(15)18-7-11-5-10(12(17)6-14)3-4-13(11)19-9(2)16/h3-5,12,17H,7H2,1-2H3/t12-/m0/s1
InChIKey JIFNEOJQBFJXOP-LBPRGKRZSA-N
Molecular Weight 263.249 g/mol
SMILES O[C@@](C#N)(c1cc(c(OC(=O)C)cc1)COC(=O)C)[H]
SPLASH splash10-0006-6900000000-c58f5c03c8aa9eefd08c
Source of Spectrum QC-8-1232-2
Synonyms 2-(acetyloxy)-5-[(R)-cyano(hydroxy)methyl]benzyl acetate
Wiley ID 869870