Z-Butylidenephthalide

• Formula: C₁₂H₁₂O₂
• Molecular weight: 188.2225
• IUPAC Standard InChI: InChI=1S/C12H12O2/c1-2-3-8-11-9-6-4-5-7-10(9)12(13)14-11/h4-8H,2-3H2,1H3/b11-8- Copy

  
• IUPAC Standard InChIKey: WMBOCUXXNSOQHM-FLIBITNWSA-N Copy
• CAS Registry Number: 72917-31-8
• Chemical structure:
  This structure is also available as a 2d Mol file
• Species with the same structure:
  • 1(3H)-Isobenzofuranone, 3-butylidene-
  • Ligustilide
• Stereoisomers:
  • Lingustilide
  • (Z)-Ligustilide
  • (E)-3-Butylidene phthalide
• Other names: (Z)-3-butylideneisobenzofuran-1(3H)-one; 1(3H)-Isobenzofuranone, 3-butylidene-, (3Z)-; 1(3H)-Isobenzofuranone, 3-butylidene-, (Z)-; (Z)-3-Butylidenephthalide; cis-Butylidenephthalide; Butylidene-phthalide(Z)-3; 3-Butylidenephthalide, (Z)-; (Z)-Butylidenphthalide
• Information on this page:
  • Gas Chromatography
  • References
  • Notes
• Options:
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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

Kovats' RI, non-polar column, temperature ramp

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Van Den Dool and Kratz RI, non-polar column, custom temperature program

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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.

Asuming, Beauchamp, et al., 2005
Asuming, W.A.; Beauchamp, P.S.; Descalzo, J.T.; Dev, B.C.; Dev, V.; Frost, S.; Ma, C.W., Essential oil composition of four Lomatium Raf. species and their chemotaxonomy, Biochem. Syst. Ecol., 2005, 33, 1, 17-26, https://doi.org/10.1016/j.bse.2004.06.005 . [all data]

Bylaite, Venskutonis, et al., 1998
Bylaite, E.; Venskutonis, R.P.; Roozen, J.P., Influence of harvesting time on the composition of volatile components in different anatomical parts of lovage (Levisticum officinale Koch.), J. Agric. Food Chem., 1998, 46, 9, 3735-3740, https://doi.org/10.1021/jf9800559 . [all data]

Andriamaharavo, 2014
Andriamaharavo, N.R., Retention Data. NIST Mass Spectrometry Data Center., NIST Mass Spectrometry Data Center, 2014. [all data]

Askari and Sefidkon, 2005
Askari, F.; Sefidkon, F., Volatile components of Pimpinella tragium Vill. from Iran, Iran. J. Pharm. Res., 2005, 2, 117-120. [all data]

Cégiéla-Carlioz, Bessière, et al., 2005
Cégiéla-Carlioz, P.; Bessière, J.-M.; David, B.; Mariotte, A.-M.; Gibbons, S.; Dijoux-Franca, M.-G., Modulation of multi-drug resistance (MDR) in Staphylococcus aureus by Osha (Ligusticum porteri L., Apiaceae) essential oil compounds, Flavour Fragr. J., 2005, 20, 6, 671-675, https://doi.org/10.1002/ffj.1584 . [all data]

Palá-Paúl, García-Jiménez, et al., 2004
Palá-Paúl, J.; García-Jiménez, R.; Pérez-Alonso, M.J.; Velasco-Negueruela, A.; Sanz, J., Essential oil composition of the leaves and stems of Meum athamanticum Jacq., from Spain, J. Chromatogr. A, 2004, 1036, 2, 245-247, https://doi.org/10.1016/j.chroma.2004.02.064 . [all data]

Notes

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