14-Acetoxy-4,5-epoxy-β-caryophyllene ( βα)
- Formula: C17H26O3
- Molecular weight: 278.3865
- IUPAC Standard InChI: InChI=1S/C17H26O3/c1-11-5-6-15-17(20-15,10-19-12(2)18)8-7-14-13(11)9-16(14,3)4/h13-15H,1,5-10H2,2-4H3
- IUPAC Standard InChIKey: BDESUTAYQPYKDJ-UHFFFAOYSA-N
- Chemical structure:
This structure is also available as a 2d Mol file - Other names: 14-Acetoxy-4,5-epoxy- β-caryophyllene
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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, polar column, custom temperature program
| Column type | Active phase | I | Reference | Comment |
|---|---|---|---|---|
| Capillary | HP-Innowax FSC | 2617. | Baser K.H.C. and Demirci B., 2007 | 60. m/0.25 mm/0.25 μm, N2; Program: 60C(10min) => 4C/min => 220C(10min) => 1C/min => 240C |
| Capillary | HP-Innowax FSC | 2617. | Baser K.H.C. and Demirci B., 2007 | 60. m/0.25 mm/0.25 μm, N2; Program: 60C(10min) => 4C/min => 220C(10min) => 1C/min => 240C |
| Capillary | HP-Innowax FSC | 2617. | Klika, Demirci, et al., 2004 | 60. m/0.25 mm/0.25 μm, N2; Program: 60C(10min) => 4C/min => 220C(10min) => 1C/min => 240C |
| Capillary | Innowax FSC | 2617. | Demirci and Baser, 2003 | 60. m/0.25 mm/0.25 μm, He; Program: 60C (10min) => 4C/min => 220C (10min) => 1C/min => 240C |
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.
Baser K.H.C. and Demirci B., 2007
Baser K.H.C.; Demirci B.,
Studies on Betula essential oils,
Arkivoc, 2007, 7, 335-348. [all data]
Klika, Demirci, et al., 2004
Klika, K.D.; Demirci, B.; Salminen, J.-P.; Ovcharenko, V.V.; Vuorela, S.; Baser, K.H.C.; Pihlaja, K.,
New, Sesquiterpenoid-Type Bicyclic Compounds from the Buds of Betula pubescens -- Ring-Contracted Products of β-Caryophyllene?,
Eur.J.Org.Chem., 2004, 2004, 12, 2627-2635, https://doi.org/10.1002/ejoc.200300808
. [all data]
Demirci and Baser, 2003
Demirci, B.; Baser, K.H.C.,
Essential oils from the buds of Betula spp. growing in Turkey,
Flavour Fragr. J., 2003, 18, 2, 87-90, https://doi.org/10.1002/ffj.1159
. [all data]
Notes
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- Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
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