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3-Cyano-1,1-dimethyl-2-oxopropyl 2-methylbenzenecarboxylate
SpectraBase Compound ID KJloAMgDfu6
InChI InChI=1S/C14H15NO3/c1-10-6-4-5-7-11(10)13(17)18-14(2,3)12(16)8-9-15/h4-7H,8H2,1-3H3
InChIKey WYFJBBSDHRZEKC-UHFFFAOYSA-N
Mol Weight 245.28 g/mol
Molecular Formula C14H15NO3
Exact Mass 245.105193 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7SPYfgAv2vw
Name 3-Cyano-1,1-dimethyl-2-oxopropyl 2-methylbenzenecarboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H15NO3
InChI InChI=1S/C14H15NO3/c1-10-6-4-5-7-11(10)13(17)18-14(2,3)12(16)8-9-15/h4-7H,8H2,1-3H3
InChIKey WYFJBBSDHRZEKC-UHFFFAOYSA-N
Literature Reference DOI 10.1021/ol1011532
Molecular Weight 245.278 g/mol
SMILES C(C)(OC(c1c(cccc1)C)=O)(C(CC#N)=O)C
SPLASH splash10-014i-4900000000-ea189286682995c83270
Source of Spectrum A1-12-3200/SM10-26
Synonyms 4-Cyano-2-methyl-3-oxobutan-2-yl 2-methylbenzoate
Wiley ID 1752402