Methoxsalen
- Formula: C12H8O4
- Molecular weight: 216.1895
- IUPAC Standard InChI: InChI=1S/C12H8O4/c1-14-12-10-8(4-5-15-10)6-7-2-3-9(13)16-11(7)12/h2-6H,1H3
- IUPAC Standard InChIKey: QXKHYNVANLEOEG-UHFFFAOYSA-N
- CAS Registry Number: 298-81-7
- 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: 7H-Furo[3,2-g][1]benzopyran-7-one, 9-methoxy-; Ammoidin; Meladinin; Meloxine; Methoxa-Dome; Oxsoralen; Xanthotoxin; Xanthotoxine; 8-Methoxy-[furano-3'.2':6.7-coumarin]; 8-Methoxypsoralen; 8-Methoxypsoralene; 8-MOP; Ammodin; Meladinine; Meladoxen; New-Meladinin; NCI-C55903; Oxypsoralen; Puvalen; 5-Benzofuranacrylic acid, 6-hydroxy-7-methoxy-, δ-lactone; 8-Methoxy-2',3',6,7-furocoumarin; 8-Methoxy-4',5',6,7-furocoumarin; 8-MP; 9-Methoxy-7H-furo[3,2-g][1]benzopyran-7-one; 8-Methoxy-6,7-furanocoumarin; Puvamet; Methoxaten; 8-Methoxyfuranocoumarin; 9-Methoxy-7H-furo(3,2-g)benzopyran-7-one; Oxsoralen-Ultra; Oxsoralen lotion; Proralone-mop; Psoralon-mop; Uvadex; Zanthotoxin; 9-methoxypsoralen; Geroxalen; 9-Methoxy-7H-furo[3,2-g]chromen-7-one; Deltapsoralen; Methoxsalene; Vitpso; NSC 45923; 9-methoxyfuro[3,2-g]chromen-7-one
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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 | Other |
|---|---|---|
| Active phase | HP-5 MS | Methyl Silicone |
| Column length (m) | 30. | |
| Carrier gas | Helium | |
| Substrate | ||
| Column diameter (mm) | 0.25 | |
| Phase thickness (μm) | 0.25 | |
| Program | 40 0C (10 min) 3 0C/min -> 200 0C 2 0C/min -> 220 0C | not specified |
| I | 2022. | 1980. |
| Reference | Schmidt, Noletto, et al., 2006 | Ardrey and Moffat, 1981 |
| Comment | 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.
Schmidt, Noletto, et al., 2006
Schmidt, J.M.; Noletto, J.A.; Vogler, B.; Setzer, W.N.,
Abaco Bush Medicine: Chemical composition of the essential oils of four aromatic medicinal plants from Abaco Island, Bahamas,
J. Herbs, Spices Medicinal Plants, 2006, 12, 3, 43-65, https://doi.org/10.1300/J044v12n03_04
. [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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