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(R)-2-acetoxy-2-(3,5-dimethoxyphenyl)acetonitrile
SpectraBase Compound ID BwNPfQoT80o
InChI InChI=1S/C12H13NO4/c1-8(14)17-12(7-13)9-4-10(15-2)6-11(5-9)16-3/h4-6,12H,1-3H3/t12-/m0/s1
InChIKey WMIJMFCPISXQKR-LBPRGKRZSA-N
Mol Weight 235.24 g/mol
Molecular Formula C12H13NO4
Exact Mass 235.084458 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID USexuydIlK
Name (R)-2-acetoxy-2-(3,5-dimethoxyphenyl)acetonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H13NO4
InChI InChI=1S/C12H13NO4/c1-8(14)17-12(7-13)9-4-10(15-2)6-11(5-9)16-3/h4-6,12H,1-3H3/t12-/m0/s1
InChIKey WMIJMFCPISXQKR-LBPRGKRZSA-N
Molecular Weight 235.239 g/mol
SMILES c1([C@](C#N)(OC(=O)C)[H])cc(OC)cc(c1)OC
SPLASH splash10-000f-0910000000-8310ebf3527dff425bb0
Source of Spectrum B-48-1741-0
Synonyms (R)-cyano(3,5-dimethoxyphenyl)methyl acetate
Wiley ID 1237019