| SpectraBase Spectrum ID |
1eR5EKlUagT |
| Name |
2,3-Dihydro-1H-dibenzo[b,f]cyclopenta[d]oxepine-5-carbonitrile |
| Appearance |
White solid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
259.099714042 u |
| Formula |
C18H13NO |
| InChI |
InChI=1S/C18H13NO/c19-11-12-8-9-18-16(10-12)14-6-3-5-13(14)15-4-1-2-7-17(15)20-18/h1-2,4,7-10H,3,5-6H2 |
| InChIKey |
SNUBMHXCTRNPID-UHFFFAOYSA-N |
| Instrument Name |
JEOL JMS-700 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/anie.201612535 |
| Molecular Weight |
259.308 g/mol |
| Reported Formula |
C18H13NO |
| SMILES |
C1=2C3=C(OC4=C(C2CCC1)C=CC=C4)C=CC(=C3)C#N |
| SPLASH |
splash10-0a4l-0090000000-db327050e99657068a3b |
| Source of Spectrum |
ACI-56-SM27-6e (DOI: 10.1002/anie.201612535) |
| Thin-Layer Chromatography |
0.31 (Hexane/EtOAc, 10:1) |
| Wiley ID |
1892884 |
![2,3-Dihydro-1H-dibenzo[b,f]cyclopenta[d]oxepine-5-carbonitrile](/api/spectrum/1eR5EKlUagT/structure.png?h=300&w=458 "2,3-Dihydro-1H-dibenzo[b,f]cyclopenta[d]oxepine-5-carbonitrile")
