| SpectraBase Spectrum ID |
66ckXbhCQ8M |
| Name |
Cadina-1,4-diene |
| CAS Registry Number |
29837-12-5 |
| 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 |
204.187800773 u |
| Formula |
C15H24 |
| 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/C15H24/c1-10(2)13-8-6-12(4)14-7-5-11(3)9-15(13)14/h7,9-10,12-13,15H,5-6,8H2,1-4H3/t12-,13-,15-/m0/s1 |
| InChIKey |
JUQGWBAOQUBVFP-YDHLFZDLSA-N |
| Molecular Weight |
204.357 g/mol |
| Nominal Mass |
204 u |
| Number of Peaks |
68 |
| SMILES |
C=1(CC=C2[C@@](C1)([C@@](CC[C@@]2(C)[H])(C(C)C)[H])[H])C |
| SPLASH |
splash10-0aor-5900000000-3b742b28bbcd49a49911 |
| Source of Spectrum |
Adams' Essential Oil Components (GC-MS), Version 4 |
| Wiley ID |
RA000223 |
