Theaspirane A

• Formula: C₁₃H₂₂O
• Molecular weight: 194.3132
• IUPAC Standard InChI: InChI=1S/C13H22O/c1-10-6-5-8-12(3,4)13(10)9-7-11(2)14-13/h6,11H,5,7-9H2,1-4H3 Copy

  
• IUPAC Standard InChIKey: GYUZHTWCNKINPY-UHFFFAOYSA-N Copy
• Chemical structure:
  This structure is also available as a 2d Mol file
• Species with the same structure:
  • 1-Oxaspiro[4.5]dec-6-ene, 2,6,10,10-tetramethyl-
  • cis-theaspirane
  • Theaspirane B
  • Theaspirane A
  • Theaspirane B
• Stereoisomers:
  • (E)-Theaspirane
• Other names: theaspirane Is I; Isotheaspirane (Isomer 1); theaspirane, I
• Information on this page:
  • Van Den Dool and Kratz RI, polar column, temperature ramp
  • References
  • Notes
• Other data available:
  • Gas Chromatography
• Options:
  • Switch to calorie-based units

Van Den Dool and Kratz RI, polar column, temperature ramp

Go To: Top, References, Notes

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

References

Go To: Top, Van Den Dool and Kratz RI, polar column, temperature ramp, Notes

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

Humpf and Schreier, 1991
Humpf, H.-U.; Schreier, P., Bound aroma compounds from the fruit and the leaves of blackberry (Rubus laciniata L.), J. Agric. Food Chem., 1991, 39, 10, 1830-1832, https://doi.org/10.1021/jf00010a028 . [all data]

Pabst, Barron, et al., 1991
Pabst, A.; Barron, D.; Etiévant, P.; Schreier, P., Studies on the enzymatic hydrolysis of bound aroma constituents from raspberry fruit pulp, J. Agric. Food Chem., 1991, 39, 1, 173-175, https://doi.org/10.1021/jf00001a034 . [all data]

Winterhalter, Lander, et al., 1987
Winterhalter, P.; Lander, V.; Schreier, P., Influence of sample preparation on the composition of quince (Cydonia oblonga, Mill.) flavor, J. Agric. Food Chem., 1987, 35, 3, 335-337, https://doi.org/10.1021/jf00075a013 . [all data]

Notes

Go To: Top, Van Den Dool and Kratz RI, polar column, temperature ramp, References

• Symbols used in this document:
  

  Tend	Final temperature
  Tstart	Initial temperature

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