![10-Benzoyloxybenzo[E]pyrene](/api/spectrum/2T5Ro1jFCFM/structure.png?h=300&w=458 "10-Benzoyloxybenzo[E]pyrene")
| SpectraBase Compound ID | 1Fvw8UzTO4i |
|---|---|
| InChI | InChI=1S/C27H16O2/c28-27(19-6-2-1-3-7-19)29-20-14-15-21-22-10-4-8-17-12-13-18-9-5-11-23(24(21)16-20)26(18)25(17)22/h1-16H |
| InChIKey | BECJODLVJXKZBO-UHFFFAOYSA-N |
| Mol Weight | 372.42 g/mol |
| Molecular Formula | C27H16O2 |
| Exact Mass | 372.11503 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 2T5Ro1jFCFM |
|---|---|
| Name | 10-Benzoyloxybenzo[E]pyrene |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 372.115029753 u |
| Formula | C27H16O2 |
| InChI | InChI=1S/C27H16O2/c28-27(19-6-2-1-3-7-19)29-20-14-15-21-22-10-4-8-17-12-13-18-9-5-11-23(24(21)16-20)26(18)25(17)22/h1-16H |
| InChIKey | BECJODLVJXKZBO-UHFFFAOYSA-N |
| Molecular Weight | 372.423 g/mol |
| SMILES | C1(=CC2=C(C=C1)C1=C3C=4C2=CC=CC4C=CC3=CC=C1)OC(C1=CC=CC=C1)=O |