Benzo[b]phenanthro[3,4-d]thiophene

Formula: C₂₀H₁₂S
Molecular weight: 284.374
IUPAC Standard InChI: InChI=1S/C20H12S/c1-2-6-15-13(5-1)9-10-14-11-12-18-20(19(14)15)16-7-3-4-8-17(16)21-18/h1-12H
IUPAC Standard InChIKey: MNZURLNXWRFPND-UHFFFAOYSA-N
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: Benzo[b]phenanthro[4,3-d]thiophene
Permanent link for this species. Use this link for bookmarking this species for future reference.
Information on this page:
Options:
- Switch to calorie-based units

Gas Chromatography

Data compiled by: NIST Mass Spectrometry Data Center, William E. Wallace, director

Column type	Active phase	I	Reference	Comment
Capillary	DB-5	486.2	Becker and Colmsjö, 1998	30. m/0.25 mm/0.25 μm, He, 110. C @ 1. min, 10. K/min, 325. C @ 5. min
Capillary	DB-5	467.2	Becker and Colmsjö, 1998	30. m/0.25 mm/0.25 μm, He, 110. C @ 1. min, 10. K/min, 325. C @ 5. min
Capillary	SE-52	487.76	Vassilaros, Kong, et al., 1982	20. m/0.30 mm/0.25 μm, H2, 40. C @ 2. min, 4. K/min; T_end: 265. C
Capillary	SE-52	470.47	Vassilaros, Kong, et al., 1982	20. m/0.30 mm/0.25 μm, H2, 40. C @ 2. min, 4. K/min; T_end: 265. C

Column type	Active phase	I	Reference	Comment
Capillary	HP-5	480.6	Becker, Colmsjo, et al., 1999	50. m/0.32 mm/0.50 μm, Helium; Program: not specified
Capillary	DB-5	481.7	Becker and Colmsjö, 1998	30. m/0.25 mm/0.25 μm, He; Program: 110C(1min) => 40C/min => 160C => 10C/min => 300C925min)
Capillary	DB-5	480.8	Becker and Colmsjö, 1998	30. m/0.25 mm/0.25 μm, He; Program: 35C(2min) => 25C/min => 160C => 3C/min => 300C(25min)
Capillary	DB-5	458.5	Becker and Colmsjö, 1998	30. m/0.25 mm/0.25 μm, He; Program: 110C(1min) => 40C/min => 160C => 10C/min => 300C925min)
Capillary	DB-5	458.0	Becker and Colmsjö, 1998	30. m/0.25 mm/0.25 μm, He; Program: 35C(2min) => 25C/min => 160C => 3C/min => 300C(25min)
Capillary	HP-5	480.6	Becker, Nilsson, et al., 1998	50. m/0.32 mm/0.5 μm, He; Program: 35C => 25C/min => 160C => 3C/min => 300C(50min)

Go To: Top, Gas Chromatography, Notes

Becker and Colmsjö, 1998
Becker, G.; Colmsjö, A., Gas chromatography-atomic emission detection for quantification of polycyclic aromatic sulfur heterocycles, Anal. Chim. Acta., 1998, 376, 3, 265-272, https://doi.org/10.1016/S0003-2670(98)00546-7 . [all data]

Vassilaros, Kong, et al., 1982
Vassilaros, D.L.; Kong, R.C.; Later, D.W.; Lee, M.L., Linear retention index system for polycyclic aromatic compounds. Critical evaluation and additional indices, J. Chromatogr., 1982, 252, 1-20, https://doi.org/10.1016/S0021-9673(01)88394-1 . [all data]

Becker, Colmsjo, et al., 1999
Becker, G.; Colmsjo, A.; Ostman, C., Determination of Thiaarenes and Polycyclic Aromatic Hydrocarbons in Workplace Air of an Aluminium Reduction Plant, Environ. Sci. Technol., 1999, 33, 9, 1321-1327, https://doi.org/10.1021/es981151t . [all data]

Becker, Nilsson, et al., 1998
Becker, G.; Nilsson, U.; Colmsjö, A.; Östman, C., Determination of polycyclic aromatic sulfur heterocyclic compounds in airborne particulate by gas chromatography with atomic emission and mass spectrometric detection, J. Chromatogr. A, 1998, 826, 1, 57-66, https://doi.org/10.1016/S0021-9673(98)00729-8 . [all data]

Go To: Top, Gas Chromatography, References

Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
The National Institute of Standards and Technology (NIST) uses its best efforts to deliver a high quality copy of the Database and to verify that the data contained therein have been selected on the basis of sound scientific judgment. However, NIST makes no warranties to that effect, and NIST shall not be liable for any damage that may result from errors or omissions in the Database.
Customer support for NIST Standard Reference Data products.