| SpectraBase Spectrum ID |
8JBXKDeDOIa |
| Name |
Sesterviolene G |
| Carrier Gas |
Helium (1 ml/min) |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C25H40 |
| GC Column |
HP5-MS (30 m x 0.25 mm, film thickness 0.50 micrometer) |
| GC Oven Program |
Oven temp 320oC |
| InChI |
InChI=1S/C25H40/c1-19(2)23-16-18-25(6)17-15-22(5)12-8-10-20(3)9-7-11-21(4)13-14-24(23)25/h10-11,15,17,19,23-24H,5,7-9,12-14,16,18H2,1-4,6H3/b17-15+,20-10+,21-11+/t23-,24-,25-/m0/s1 |
| InChIKey |
ZOFLFLLHVFTRDR-VINPQIGYSA-N |
| Inlet Type |
splitless or split (50:1) |
| Instrument Name |
Agilent 7890B-5977A |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/anie.202215688 |
| Molecular Weight |
340.595 g/mol |
| Optical Rotation |
[a]D20 = -56.7 (c = 0.03, CH2Cl2) |
| Quality |
400 |
| Reported Formula |
C25H40 |
| SMILES |
C1\C=C\(CC\C=C\(CC[C@@]2([C@@](\C=C\C(C1)=C)(CC[C@]2(C(C)C)[H])C)[H])C)C |
| SPLASH |
splash10-05o3-9822000000-bbd7538252e71f3b4fea |
| Source of Spectrum |
ACI-62-SM36-7 (DOI: 10.1002/anie.202215688) |
| Thin-Layer Chromatography |
0.4 (n-hexane, 100%) |
| Wiley ID |
1908263 |
