| SpectraBase Spectrum ID |
EpDZYsicddj |
| Name |
Guaiazulene |
| CAS Registry Number |
489-84-9 |
| 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 |
198.140850580 u |
| Formula |
C15H18 |
| 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/C15H18/c1-10(2)13-7-5-11(3)14-8-6-12(4)15(14)9-13/h5-10H,1-4H3 |
| InChIKey |
FWKQNCXZGNBPFD-UHFFFAOYSA-N |
| Molecular Weight |
198.309 g/mol |
| Nominal Mass |
198 u |
| Number of Peaks |
146 |
| SMILES |
Cc1c2c(c(C)ccc(c2)C(C)C)cc1 |
| SPLASH |
splash10-001j-0900000000-e69546385590fc96a009 |
| Source of Spectrum |
Adams' Essential Oil Components (GC-MS), Version 4 |
| Wiley ID |
RA001660 |
