| SpectraBase Spectrum ID |
B1xypL3pt5s |
| Name |
.beta.-Tocotrienol |
| CAS Registry Number |
490-23-3 |
| 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 |
410.318480590 u |
| Formula |
C28H42O2 |
| GC Column |
HP-5ms (30 m × 0.25 mm ID x 0.25 μm film thickness) |
| InChI |
InChI=1S/C28H42O2/c1-20(2)11-8-12-21(3)13-9-14-22(4)15-10-17-28(7)18-16-25-24(6)26(29)19-23(5)27(25)30-28/h11,13,15,19,29H,8-10,12,14,16-18H2,1-7H3/b21-13+,22-15+/t28-/m1/s1 |
| InChIKey |
FGYKUFVNYVMTAM-WAZJVIJMSA-N |
| Molecular Weight |
410.642 g/mol |
| Nominal Mass |
410 u |
| Number of Peaks |
334 |
| SMILES |
Oc1c(c2CC[C@](Oc2c(c1)C)(CC\C=C\(CC\C=C\(CCC=C(C)C)C)C)C)C |
| SPLASH |
splash10-0w29-4910200000-ec0685acbd811735e23d |
| Source |
Cayman Chemicals |
| Source of Spectrum |
Biologically and Environmentally Important Organic Compounds: GCMS Library |
| Wiley ID |
VI001798 |
