| SpectraBase Compound ID | C0O5Yvtm9Nz |
|---|---|
| InChI | InChI=1S/C37H54O3/c1-25(2)8-7-9-26(3)32-17-18-33-31-16-13-28-24-30(20-22-36(28,4)34(31)21-23-37(32,33)5)40-35(38)19-12-27-10-14-29(39-6)15-11-27/h10-15,19,25-26,30-34H,7-9,16-18,20-24H2,1-6H3/b19-12+/t26-,30?,31?,32-,33?,34?,36+,37-/m1/s1 |
| InChIKey | SVQRQYIYDKWIKD-IOOUNPESSA-N |
| Mol Weight | 546.8 g/mol |
| Molecular Formula | C37H54O3 |
| Exact Mass | 546.407296 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | FSbBBmLLBoX |
|---|---|
| Name | Cholesteryl - 4-Methoxycinnamate |
| Alternate Name(s) | Cholest-5-en-3-yl (2E)-3-(4-methoxyphenyl)-2-propenoate |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C37H54O3 |
| InChI | InChI=1S/C37H54O3/c1-25(2)8-7-9-26(3)32-17-18-33-31-16-13-28-24-30(20-22-36(28,4)34(31)21-23-37(32,33)5)40-35(38)19-12-27-10-14-29(39-6)15-11-27/h10-15,19,25-26,30-34H,7-9,16-18,20-24H2,1-6H3/b19-12+/t26-,30?,31?,32-,33?,34?,36+,37-/m1/s1 |
| InChIKey | SVQRQYIYDKWIKD-IOOUNPESSA-N |
| Molecular Weight | 546.836 g/mol |
| SMILES | [C@@]12(C(C3CC=C4[C@@](C3CC2)(CCC(OC(\C=C\c2ccc(cc2)OC)=O)C4)C)CC[C@@]1([C@@](CCCC(C)C)(C)[H])[H])C |
| SPLASH | splash10-014i-2729000000-40eaa450f7e25c9e4904 |
| Source of Spectrum | X2-58-282-8 |
| Wiley ID | 1605830 |