Morphinan-6-ol, 7,8-didehydro-4,5-epoxy-3-methoxy-17-methyl-, acetate (ester), (5α,6α)-
- Formula: C20H23NO4
- Molecular weight: 341.4009
- IUPAC Standard InChI: InChI=1S/C20H23NO4/c1-11(22)24-16-7-5-13-14-10-12-4-6-15(23-3)18-17(12)20(13,19(16)25-18)8-9-21(14)2/h4-7,13-14,16,19H,8-10H2,1-3H3
- IUPAC Standard InChIKey: MFXFQKMUCYHPFQ-UHFFFAOYSA-N
- CAS Registry Number: 6703-27-1
- 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. - Other names: Morphinan-6α-ol, 7,8-didehydro-4,5α-epoxy-3-methoxy-17-methyl-, acetate (ester); Codeine, acetate (ester); Codeinone, acetyldihydro-; 6-Acetylcodeine; Morphinan-6-α-ol, 7,8-didehydro-4,5-α-epoxy-3-methoxy-17-methyl-, acetate; Codeine, acetyl-; O-Acetylcodeine; Codeine, acetate; Acetylcodeine
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- Other data available:
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Normal alkane RI, non-polar column, custom temperature program
Go To: Top, References, Notes
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
| Column type | Capillary | Capillary | Capillary | Capillary | Capillary |
|---|---|---|---|---|---|
| Active phase | Polymethylsiloxane, (PMS-20000) | Polydimethyl siloxanes | BP-1 | BP-1 | BP-1 |
| Column length (m) | 12. | 12. | 12. | 12. | |
| Carrier gas | He | He | He | He | |
| Substrate | |||||
| Column diameter (mm) | 0.20 | 0.22 | 0.22 | 0.22 | |
| Phase thickness (μm) | 0.33 | 0.25 | 0.25 | 0.25 | |
| Program | not specified | not specified | 120 0X 8 0C/min -> 270 0C 25 0C/min -> 300 0C (5 min) | 120 0X 8 0C/min -> 270 0C 25 0C/min -> 300 0C (5 min) | 120 0X 8 0C/min -> 270 0C 25 0C/min -> 300 0C (5 min) |
| I | 2502. | 2505. | 2483. | 2485. | 2485. |
| Reference | Gambaro, Saligari, et al., 1997 | Schutz and Wollrab A., 1988 | Stowell and Wilson, 1985 | Stowell and Wilson, 1985 | Stowell and Wilson, 1985 |
| Comment | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI |
| Column type | Capillary | Capillary | Other |
|---|---|---|---|
| Active phase | BP-1 | OV-1, SE-30, Methyl silicone, SP-2100, OV-101, DB-1, etc. | Methyl Silicone |
| Column length (m) | 12. | 50. | |
| Carrier gas | He | Hydrogen | |
| Substrate | |||
| Column diameter (mm) | 0.22 | 0.32 | |
| Phase thickness (μm) | 0.25 | ||
| Program | 120 0X 8 0C/min -> 270 0C 25 0C/min -> 300 0C (5 min) | not specified | not specified |
| I | 2484. | 2530. | 2510. |
| Reference | Stowell and Wilson, 1985 | Waggott and Davies, 1984 | Ardrey and Moffat, 1981 |
| Comment | MSDC-RI | MSDC-RI | MSDC-RI |
References
Go To: Top, Normal alkane RI, non-polar column, custom temperature program, Notes
Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.
Gambaro, Saligari, et al., 1997
Gambaro, V.; Saligari, E.; Froldi, R.; Bianchi, L.,
Analysis of street drugs by means of HRGC,
Bollettino Chimico Farmaceutica, 1997, 36, 4, 359-367. [all data]
Schutz and Wollrab A., 1988
Schutz, H.; Wollrab A.,
The significance of the retention index in toxicologic analysis II,
Pharmazie in unzerer Zeit, 1988, 17, 4, 97-101. [all data]
Stowell and Wilson, 1985
Stowell, A.; Wilson, L.,
Use of retention indices in drug screening by capillary gas chromatography, Rep. # CD 2362, Department of Scientific and Industrial Reseach, Chemistry Division, Lower Hutt, NZ, 1985, 32. [all data]
Waggott and Davies, 1984
Waggott, A.; Davies, I.W.,
Identification of organic pollutants using linear temperature programmed retention indices (LTPRIs) - Part II, 1984, retrieved from http://dwi.defra.gov.uk/research/completed-research/reports/dwi0383.pdf. [all data]
Ardrey and Moffat, 1981
Ardrey, R.E.; Moffat, A.C.,
Gas-liquid chromatographic retention indices of 1318 substances of toxicological interest on SE-30 or OV-1 stationary phase,
J. Chromatogr., 1981, 220, 3, 195-252, https://doi.org/10.1016/S0021-9673(00)81925-1
. [all data]
Notes
Go To: Top, Normal alkane RI, non-polar column, custom temperature program, References
- Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
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