SpectraBase Compound ID | pUlGqFlslu |
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InChI | InChI=1S/C21H16O2/c22-21(23)17-6-2-5-14-11-15-8-7-12-3-1-4-13-9-10-16(19(14)17)20(15)18(12)13/h1,3-4,7-11,17H,2,5-6H2,(H,22,23) |
InChIKey | BTSKMJQUPBUHHB-UHFFFAOYSA-N |
Mol Weight | 300.36 g/mol |
Molecular Formula | C21H16O2 |
Exact Mass | 300.11503 g/mol |
SpectraBase Spectrum ID | Jl1pA2k3Y4 |
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Name | 7,8,9,10-tetrahydrobenzo[a]pyrene-10-carboxylic acid |
Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C21H16O2 |
InChI | InChI=1S/C21H16O2/c22-21(23)17-6-2-5-14-11-15-8-7-12-3-1-4-13-9-10-16(19(14)17)20(15)18(12)13/h1,3-4,7-11,17H,2,5-6H2,(H,22,23) |
InChIKey | BTSKMJQUPBUHHB-UHFFFAOYSA-N |
Instrument Name | Varian CFT-20 |
Sadtler NMR Number | 44581M |
Solvent | DMSO-d6 |