| SpectraBase Spectrum ID |
Heub5tykVLC |
| Name |
Capillene |
| CAS Registry Number |
520-74-1 |
| Copyright |
Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved. |
| Exact Mass |
154.078250322 u |
| Formula |
C12H10 |
| GC Column |
J&W DB-5 (30 m x 0.25 mm ID x 0.25 μm film thickness) |
| GC Oven Program |
60 °C to 246 °C at 3 °C/min. |
| InChI |
InChI=1S/C12H10/c1-2-3-4-6-9-12-10-7-5-8-11-12/h5,7-8,10-11H,9H2,1H3 |
| InChIKey |
WXQYRBLGGSLJHA-UHFFFAOYSA-N |
| Molecular Weight |
154.212 g/mol |
| Nominal Mass |
154 u |
| Number of Peaks |
126 |
| SMILES |
c1(ccccc1)CC#CC#CC |
| SPLASH |
splash10-0udi-3900000000-4cf1b0b06a0e3ef4072a |
| Source |
ex SANTOLINA ROSMARINIFOLIA |
| Source of Spectrum |
Adams' Essential Oil Components (GC-MS), Version 4 |
| Wiley ID |
RA000251 |
