O-(4-Hydroxybenzoyl)tropine
- Formula: C15H19NO3
- Molecular weight: 261.3163
- IUPAC Standard InChI: InChI=1S/C15H19NO3/c1-16-11-4-5-12(16)9-14(8-11)19-15(18)10-2-6-13(17)7-3-10/h2-3,6-7,11-12,14,17H,4-5,8-9H2,1H3
- IUPAC Standard InChIKey: VXNQEEYJSNEORM-UHFFFAOYSA-N
- CAS Registry Number: 198898-04-3
- Chemical structure:
This structure is also available as a 2d Mol file - Stereoisomers:
- Other names: 3β-(4-Hydroxybenzoyloxy)tropane
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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 | 2282. | 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 | VF-5MS | 2369. | Todua, 2011 | 30. m/0.25 mm/0.25 μm, He; Tstart: 60. C; Tend: 270. 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]
Todua, 2011
Todua, N.G.,
Retention Data. NIST Mass Spectrometry Data Center., NIST Mass Spectrometry Data Center, 2011. [all data]
Notes
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- Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
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