1,4-Dioxane-2-carboxylic acid, 3-phenyl, ethyl ester

• Formula: C₁₃H₁₆O₄
• Molecular weight: 236.2637
• IUPAC Standard InChI: InChI=1S/C13H16O4/c1-2-15-13(14)12-11(16-8-9-17-12)10-6-4-3-5-7-10/h3-7,11-12H,2,8-9H2,1H3 Copy

  
• IUPAC Standard InChIKey: AZBRMQHBGBXAAL-UHFFFAOYSA-N Copy
• Chemical structure:
  This structure is also available as a 2d Mol file
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Gas Chromatography

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Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.

Data compiled by: NIST Mass Spectrometry Data Center, William E. Wallace, director

Normal alkane RI, non-polar column, temperature ramp

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References

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Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.

Zenkevich, Kharicheva, et al., 1999
Zenkevich, I.G.; Kharicheva, E.M.; Kostikov, R.R., Application of Molecular Dynamics Methods in Chromato Mass Spectral Identification of Products of Interaction of Ethoxycarbonylcarbene with Various Substrates, Zh. Org. Khim. (Rus.), 1999, 35, 11, 1600-1606. [all data]

Notes

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• Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
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