| SpectraBase Spectrum ID |
HERYRLBJ3c |
| Name |
[1,3]Dioxolo[4',5':4,5]benzo[1,2-d]benzo[b]benzo[f]oxepine-6-carbonitrile |
| Appearance |
White solid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
313.073893215 u |
| Formula |
C20H11NO3 |
| InChI |
InChI=1S/C20H11NO3/c21-10-12-5-6-18-16(7-12)15-9-20-19(22-11-23-20)8-14(15)13-3-1-2-4-17(13)24-18/h1-9H,11H2 |
| InChIKey |
OTIXQJTWNGVXMA-UHFFFAOYSA-N |
| Instrument Name |
JEOL JMS-700 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/anie.201612535 |
| Molecular Weight |
313.312 g/mol |
| Reported Formula |
C20H11NO3 |
| SMILES |
C1=C2C(=CC=3C4=C(OC5=C(C13)C=CC=C5)C=CC(=C4)C#N)OCO2 |
| SPLASH |
splash10-03di-0029000000-1ad96a7410edc39caf69 |
| Source of Spectrum |
ACI-56-SM25-6b (DOI: 10.1002/anie.201612535) |
| Thin-Layer Chromatography |
0.14 (Hexane/EtOAc, 10:1) |
| Wiley ID |
1892881 |
![[1,3]Dioxolo[4',5':4,5]benzo[1,2-d]benzo[b]benzo[f]oxepine-6-carbonitrile](/api/spectrum/HERYRLBJ3c/structure.png?h=300&w=458 "[1,3]Dioxolo[4',5':4,5]benzo[1,2-d]benzo[b]benzo[f]oxepine-6-carbonitrile")
