| SpectraBase Spectrum ID |
AIURB3wdnFS |
| Name |
Isopulegol |
| CAS Registry Number |
59905-54-3 |
| 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 |
154.135765199 u |
| Formula |
C10H18O |
| 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/C10H18O/c1-7(2)9-5-4-8(3)6-10(9)11/h8-11H,1,4-6H2,2-3H3/t8-,9-,10+/m1/s1 |
| InChIKey |
ZYTMANIQRDEHIO-BBBLOLIVSA-N |
| Molecular Weight |
154.253 g/mol |
| Nominal Mass |
154 u |
| Number of Peaks |
97 |
| SMILES |
O[C@@]1([C@](CC[C@](C1)(C)[H])(C(=C)C)[H])[H] |
| SPLASH |
splash10-01bc-9200000000-d88f957e0611c4037e8c |
| Source of Spectrum |
Adams' Essential Oil Components (GC-MS), Version 4 |
| Wiley ID |
RA000781 |
