3α-Acetoxytropane
- Formula: C10H17NO2
- Molecular weight: 183.2475
- IUPAC Standard InChI: InChI=1S/C10H17NO2/c1-7(12)13-10-5-8-3-4-9(6-10)11(8)2/h8-10H,3-6H2,1-2H3/t8-,9+,10+
- IUPAC Standard InChIKey: MDIDMOWWLBGYPG-MYJAWHEDSA-N
- Chemical structure:
This structure is also available as a 2d Mol file or as a computed 3d SD file
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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 | DB-1 | 1308. | Jenett-Siems, Weigl, et al., 2005 | He, 6. K/min; Column length: 30. m; Column diameter: 0.32 mm; Tstart: 70. C; Tend: 300. C |
Van Den Dool and Kratz RI, non-polar column, temperature ramp
| Column type | Active phase | I | Reference | Comment |
|---|---|---|---|---|
| Capillary | HP-5MS | 1340. | Humam, Munoz, et al., 2007 | 30. m/0.25 mm/0.25 μm, 70. C @ 1. min, 5. K/min, 285. C @ 15. min |
Van Den Dool and Kratz RI, non-polar column, custom temperature program
| Column type | Active phase | I | Reference | Comment |
|---|---|---|---|---|
| Capillary | HP-5MS | 1341. | Humam, Munoz, et al., 2007 | 30. m/0.25 mm/0.25 μm; Program: not specified |
Normal alkane RI, non-polar column, temperature ramp
| Column type | Active phase | I | Reference | Comment |
|---|---|---|---|---|
| Capillary | OV-1 | 1303. | Zayed and Wink, 2004 | He, 120. C @ 3. min, 8. K/min; Column length: 30. m; Column diameter: 0.25 mm; Tend: 300. C |
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.
Jenett-Siems, Weigl, et al., 2005
Jenett-Siems, K.; Weigl, R.; Böhm, A.; Mann, P.; Tofern-Reblin, B.; Ott, S.C.; Ghomian, A.; Kaloga, M.; Siems, K.; Witte, L.; Hilker, M.; Müller, F.; Eich, E.,
Chemotaxonomy of the pantropical genus Merremia (Convolvulaceae) based on the distribution of tropane alkaloids,
Phytochemistry, 2005, 66, 12, 1448-1464, https://doi.org/10.1016/j.phytochem.2005.04.027
. [all data]
Humam, Munoz, et al., 2007
Humam, M.; Munoz, O.; Christen, P.; Hostettmann, K.,
Tropane alkaloids of the aerial part of Schizanthus tricolor,
Nat. Prod. Commun., 2007, 2, 7, 743-747. [all data]
Zayed and Wink, 2004
Zayed, R.; Wink, M.,
Induction of tropane alkaloid formation in transformed root cultures of Brugmansia suaveolens (Solanaceae),
Z. Naturforsch. C:, 2004, 59, 11-12, 863-867. [all data]
Notes
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- Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
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