(1S ,1'R )-1-(6,6-dimethyl-bicyclo[3.1.1]hept-2-en- 2-yl)-1-hydroxy-2-propanone (S)
- Formula: C12H18O2
- Molecular weight: 194.2701
- IUPAC Standard InChI: InChI=1S/C12H18O2/c1-7(13)11(14)9-5-4-8-6-10(9)12(8,2)3/h5,8,10-11,14H,4,6H2,1-3H3/t8-,10-,11-/m1/s1
- IUPAC Standard InChIKey: XMRUZCWDOKBXED-FBIMIBRVSA-N
- Chemical structure:
This structure is also available as a 2d Mol file - 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
Normal alkane RI, non-polar column, temperature ramp
| Column type | Active phase | I | Reference | Comment |
|---|---|---|---|---|
| Capillary | Optima-5MS | 1383. | Zorn, Schüler, et al., 2003 | 30. m/0.25 mm/0.25 μm, H2, 4. K/min; Tstart: 40. C; Tend: 230. C |
Normal alkane RI, polar column, temperature ramp
| Column type | Active phase | I | Reference | Comment |
|---|---|---|---|---|
| Capillary | DB-Wax | 2036. | Zorn, Schüler, et al., 2003 | 30. m/0.32 mm/0.25 μm, He, 40. C @ 3. min, 3. K/min; Tend: 230. 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.
Zorn, Schüler, et al., 2003
Zorn, H.; Schüler, M.; Berger, R.G.,
Pyruvate decarboxylase catalysed formation of terpenoid α-hydroxy ketones,
Biocatal. Biotransform., 2003, 21, 6, 341-347, https://doi.org/10.1080/10242420310001630173
. [all data]
Notes
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- Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
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