| SpectraBase Spectrum ID |
B2HJkD8RRpo |
| Name |
Guaiazulene |
| CAS Registry Number |
489-84-9 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C15H18 |
| GC Column |
J&W DB-5 (30 m x 0.25 mm ID x 0.25 ??m 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 |
| 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 |
1887421 |
