9-Angeloylretronecine
- Formula: C13H19NO3
- Molecular weight: 237.2949
- IUPAC Standard InChI: InChI=1S/C13H19NO3/c1-3-9(2)13(16)17-8-10-4-6-14-7-5-11(15)12(10)14/h3-4,11-12,15H,5-8H2,1-2H3/b9-3-/t11-,12+/m1/s1
- IUPAC Standard InChIKey: VYUQPLFRNDQDHW-KKXNAPIPSA-N
- Chemical structure:
This structure is also available as a 2d Mol file or as a computed 3d SD file
The 3d structure may be viewed using Java or Javascript. - Stereoisomers:
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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
| Column type | Active phase | I | Reference | Comment |
|---|---|---|---|---|
| Capillary | OV-1 | 1797. | El-Shazly, El-Domiaty, et al., 1998 | He, 6. K/min; Column length: 30. m; Tstart: 150. C; Tend: 300. C |
Van Den Dool and Kratz RI, non-polar column, temperature ramp
| Column type | Active phase | I | Reference | Comment |
|---|---|---|---|---|
| Capillary | DB-1 | 1797. | Weber, Eisenreich, et al., 1999 | He, 6. K/min; Column length: 30. m; Column diameter: 0.32 mm; Tstart: 150. C; Tend: 300. C |
| Capillary | DB-1 | 1797. | Witte, Rubiolo, et al., 1992 | He, 6. K/min; Column length: 30. m; Column diameter: 0.32 mm; Tstart: 150. C; Tend: 300. C |
| Capillary | DB-5 | 1840. | Witte, Rubiolo, et al., 1992 | He, 6. K/min; Column length: 30. m; Column diameter: 0.32 mm; Tstart: 150. C; Tend: 300. C |
Normal alkane RI, non-polar column, custom temperature program
| Column type | Active phase | I | Reference | Comment |
|---|---|---|---|---|
| Capillary | DB-1 | 1795. | Asres, Sporer, et al., 2004 | He; Column length: 30. m; Column diameter: 0.3 mm; Program: 120C => (6C/min or 1.5C/min) => 300C |
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.
El-Shazly, El-Domiaty, et al., 1998
El-Shazly, A.; El-Domiaty, M.; Witte, L.; Wink, M.,
Pyrrolizidine alkaloids in members of the boraginaceae from Sinai (Egypt),
Biochem. Syst. Ecol., 1998, 26, 6, 619-636, https://doi.org/10.1016/S0305-1978(98)00028-3
. [all data]
Weber, Eisenreich, et al., 1999
Weber, S.; Eisenreich, W.; Bacher, A.; Hartmann, T.,
Pyrrolizidine alkaloids of the lycopsamine type: biosynthesis of thracelanthic acid,
Phytochemistry, 1999, 50, 6, 1005-1014, https://doi.org/10.1016/S0031-9422(98)00203-9
. [all data]
Witte, Rubiolo, et al., 1992
Witte, L.; Rubiolo, P.; Bicchi, C.; Hartmann, T.,
Comparative analysis of pyrrolizidine alkaloids from natural sources by gas chromatography-mass spectrometry,
Phytochemistry, 1992, 32, 1, 187-196, https://doi.org/10.1016/0031-9422(92)80130-7
. [all data]
Asres, Sporer, et al., 2004
Asres, K.; Sporer, F.; Wink, M.,
Patterns of pyrrolizidine alkaloids in 12 Ethiopian Crotalaria species,
Biochem. Syst. Ecol., 2004, 32, 10, 915-930, https://doi.org/10.1016/j.bse.2004.03.004
. [all data]
Notes
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- Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
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