Lup-20(29)-en-3-ol, acetate, (3β)-
- Formula: C32H52O2
- Molecular weight: 468.7541
- IUPAC Standard InChI: InChI=1S/C32H52O2/c1-20(2)22-12-15-29(6)18-19-31(8)23(27(22)29)10-11-25-30(7)16-14-26(34-21(3)33)28(4,5)24(30)13-17-32(25,31)9/h22-27H,1,10-19H2,2-9H3/t22?,23?,24?,25?,26-,27?,29?,30?,31?,32?/m0/s1
- IUPAC Standard InChIKey: ODSSDTBFHAYYMD-XKBDXGRBSA-N
- CAS Registry Number: 1617-68-1
- Chemical structure:
This structure is also available as a 2d Mol file - Stereoisomers:
- Other names: Lup-20(29)-en-3β-ol, acetate; Lupenyl acetate; Lupeol acetate; Lupeyl acetate; 3-O-Acetyllupeol; 20(29)-Lupenol acetate; Lup-20(29)-en-3-yl acetate; 3β-Acetoxylup-20(29)-ene; Lupeol (20[29]-lupenol) acetate
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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, isothermal
| Column type | Active phase | Temperature (C) | I | Reference | Comment |
|---|---|---|---|---|---|
| Capillary | OV-1 | 260. | 3372. | Itoh, Tani, et al., 1982 | N2; Column length: 30. m; Column diameter: 0.30 mm |
Van Den Dool and Kratz RI, non-polar column, custom temperature program
| Column type | Active phase | I | Reference | Comment |
|---|---|---|---|---|
| Capillary | HP-5MS | 3525. | Andriamaharavo, 2014 | 30. m/0.25 mm/0.25 μm, He; Program: 60C (1 min) => 5 C/min => 210C => 10 C/min => 280C (15 min) |
Normal alkane RI, non-polar column, isothermal
| Column type | Active phase | Temperature (C) | I | Reference | Comment |
|---|---|---|---|---|---|
| Packed | SE-30 | 250. to 280. | 3380. | Corbett, Cong, et al., 1987 | Gas-Chrom Q (80-100 mesh); Column length: 1.2 m |
References
Go To: Top, Gas Chromatography, Notes
Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.
Itoh, Tani, et al., 1982
Itoh, T.; Tani, H.; Fukushima, K.; Tamura, T.; Matsumoto, T.,
Structure-Retention Relationship of Sterols and Triterpene Alcohols in Gas Chromatography on a Glass Capillary Column,
J. Chromatogr., 1982, 234, 1, 65-76, https://doi.org/10.1016/S0021-9673(00)81781-1
. [all data]
Andriamaharavo, 2014
Andriamaharavo, N.R.,
Retention Data. NIST Mass Spectrometry Data Center., NIST Mass Spectrometry Data Center, 2014. [all data]
Corbett, Cong, et al., 1987
Corbett, R.E.; Cong, A.N.T.; Holland, P.T.; Wilkins, A.L.,
Lichenms and fungi. XVIII. Extractives from Pseudocyphellaria rubella,
Austr. J. Chem., 1987, 40, 3, 461-468, https://doi.org/10.1071/CH9870461
. [all data]
Notes
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- Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
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