| SpectraBase Compound ID | AXiZJHzIlI9 |
|---|---|
| InChI | InChI=1S/C45H80O2/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/h26,35-36,38-42H,7-25,27-34H2,1-6H3/t36-,38+,39?,40?,41?,42?,44+,45-/m1/s1 |
| InChIKey | XHRPOTDGOASDJS-GHOVPUJYSA-N |
| Mol Weight | 653.1 g/mol |
| Molecular Formula | C45H80O2 |
| Exact Mass | 652.615832 g/mol |
Transmission Infrared (IR) Spectrum
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| SpectraBase Spectrum ID | FTkkUwhvkte |
|---|---|
| Name | Cholesteryl stearate |
| Source of Sample | Sigma-Aldrich Company LLC |
| Catalog Number | C79409 |
| Lot Number | 01129HX |
| CAS Registry Number | 35602-69-8 |
| Copyright | Copyright © 2012-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C45H80O2 |
| InChI | InChI=1S/C45H80O2/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/h26,35-36,38-42H,7-25,27-34H2,1-6H3/t36-,38+,39?,40?,41?,42?,44+,45-/m1/s1 |
| InChIKey | XHRPOTDGOASDJS-GHOVPUJYSA-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(CCCCCCCCCCCCCCCCC)=O)[H] |
| Source of Spectrum | Forensic Spectral Research |
| Technique | KBr0 |