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Acetic acid, [2-(cyanohydroxymethyl)-6-methoxyphenoxy]-, ethyl ester
SpectraBase Compound ID CJdhYjfAgtR
InChI InChI=1S/C13H15NO5/c1-3-18-12(16)8-19-13-9(10(15)7-14)5-4-6-11(13)17-2/h4-6,10,15H,3,8H2,1-2H3
InChIKey QTRIQJXYWRHQKC-UHFFFAOYSA-N
Mol Weight 265.26 g/mol
Molecular Formula C13H15NO5
Exact Mass 265.095023 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CUD5HtakBLZ
Name Acetic acid, [2-(cyanohydroxymethyl)-6-methoxyphenoxy]-, ethyl ester
Alternate Name(s) (2-ethoxycarbonylmethoxy-3-methoxyphenyl)hydroxyacetonitrile Ethyl {2-[cyano(hydroxy)methyl]-6-methoxyphenoxy}acetate
CAS Registry Number 76322-10-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H15NO5
InChI InChI=1S/C13H15NO5/c1-3-18-12(16)8-19-13-9(10(15)7-14)5-4-6-11(13)17-2/h4-6,10,15H,3,8H2,1-2H3
InChIKey QTRIQJXYWRHQKC-UHFFFAOYSA-N
Molecular Weight 265.265 g/mol
SMILES OC(C#N)c1c(OCC(=O)OCC)c(OC)ccc1
SPLASH splash10-00kr-3920000000-0018fd5e6c49fd1f6500
Source of Spectrum AN-89-474-0
Wiley ID 1268842