| SpectraBase Compound ID | KTRwTKc4jos |
|---|---|
| InChI | InChI=1S/C45H76O2/c1-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-25-43(46)47-38-30-32-44(5)37(34-38)26-27-39-41-29-28-40(36(4)24-22-23-35(2)3)45(41,6)33-31-42(39)44/h11-12,14-15,26,35-36,38-42H,7-10,13,16-25,27-34H2,1-6H3/b12-11-,15-14-/t36-,38+,39?,40?,41?,42?,44+,45-/m1/s1 |
| InChIKey | NAACPBBQTFFYQB-XHDSEGDBSA-N |
| Mol Weight | 649.1 g/mol |
| Molecular Formula | C45H76O2 |
| Exact Mass | 648.584532 g/mol |
Transmission Infrared (IR) Spectrum
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | GCXVLghR2fA |
|---|---|
| Name | Cholesteryl linoleate |
| Source of Sample | Sigma-Aldrich Company LLC |
| Catalog Number | C0289 |
| Lot Number | SLBF0082V |
| CAS Registry Number | 604-33-1 |
| Classification | cholesterol type |
| Copyright | Copyright © 2012-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C45H76O2 |
| InChI | InChI=1S/C45H76O2/c1-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-25-43(46)47-38-30-32-44(5)37(34-38)26-27-39-41-29-28-40(36(4)24-22-23-35(2)3)45(41,6)33-31-42(39)44/h11-12,14-15,26,35-36,38-42H,7-10,13,16-25,27-34H2,1-6H3/b12-11-,15-14-/t36-,38+,39?,40?,41?,42?,44+,45-/m1/s1 |
| InChIKey | NAACPBBQTFFYQB-XHDSEGDBSA-N |
| Instrument Name | Bio-Rad FTS |
| SMILES | C1C[C@@](C\C2=C\CC3C4[C@](CCC3[C@@]12C)(C(CC4)[C@@](CCCC(C)C)(C)[H])C)(OC(CCCCCCC\C=C/C\C=C/CCCCC)=O)[H] |
| Scan Speed (number) | 5 |
| Source of Spectrum | Forensic Spectral Research |
| Synonyms | 3β-Hydroxy-5-cholestene 3-linoleate; 5-Cholesten-3β-ol 3-linoleate; Cholesteryl 9,12-octadecadienoate; Cholesteryl octadecadienoate |
| Technique | Melt (Crystalline) |