| SpectraBase Spectrum ID |
LXkraChOOFu |
| Name |
Cubitene |
| CAS Registry Number |
66723-19-1 |
| 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 |
272.250401030 u |
| Formula |
C20H32 |
| 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/C20H32/c1-15(2)19-12-10-17(5)8-7-9-18(6)11-13-20(14-19)16(3)4/h8,11,19-20H,1,3,7,9-10,12-14H2,2,4-6H3/b17-8-,18-11+/t19-,20+/m1/s1 |
| InChIKey |
CIJBIDDWTJGAAD-BDHDXMEOSA-N |
| Molecular Weight |
272.476 g/mol |
| Nominal Mass |
272 u |
| Number of Peaks |
173 |
| SMILES |
C1\C=C/(CC[C@@](C[C@@](C\C=C\(C1)C)([H])C(=C)C)([H])C(C)=C)C |
| SPLASH |
splash10-05mo-9600000000-4d41dff12d07f3b4c843 |
| Source of Spectrum |
Adams' Essential Oil Components (GC-MS), Version 4 |
| Wiley ID |
RA000397 |
