[1,1,1,3,3-2H5]-4-Benzyloxy-2-butanone

• Formula: C₁₁H₉D₅O₂
• Molecular weight: 183.2585
• IUPAC Standard InChI: InChI=1S/C11H14O2/c1-10(12)7-8-13-9-11-5-3-2-4-6-11/h2-6H,7-9H2,1H3/i1D3,7D2 Copy

  
• IUPAC Standard InChIKey: BTOZGSIVAZGXCH-WRMAMSRYSA-N Copy
• Chemical structure:
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• Isotopologues:
  • [1,1,1-2H3]-4-Benzyloxy-2-butanone
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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, custom temperature program

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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.

Dickschat J.S., Bode H.B., et al., 2005
Dickschat J.S.; Bode H.B.; Mahmud T.; Muller R.; Schulz S., A novel type of geosmin biosynthesis in myxobacteria, J. Org. Chem., 2005, 70, 13, 5174-5182, https://doi.org/10.1021/jo050449g . [all data]

Notes

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