| SpectraBase Spectrum ID |
3q6uuxAPse |
| Name |
Isogeijerene C |
| CAS Registry Number |
106494-41-1 |
| 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 |
162.140850580 u |
| Formula |
C12H18 |
| 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/C12H18/c1-5-12(4)9-7-6-8-11(12)10(2)3/h5-6,8H,1,7,9H2,2-4H3 |
| InChIKey |
DDDUDPZNWNWAHI-UHFFFAOYSA-N |
| Molecular Weight |
162.276 g/mol |
| Nominal Mass |
162 u |
| Number of Peaks |
105 |
| SMILES |
C1(C(CCC=C1)(C=C)C)=C(C)C |
| SPLASH |
splash10-004l-9300000000-506d879f81dacb50bc39 |
| Source of Spectrum |
Adams' Essential Oil Components (GC-MS), Version 4 |
| Wiley ID |
RA000761 |
