| SpectraBase Compound ID | 7gcQUcR0m1M |
|---|---|
| InChI | InChI=1S/C38H56O5/c1-24(2)9-8-10-25(3)30-14-15-31-29-13-12-27-23-28(17-19-37(27,4)32(29)18-20-38(30,31)5)43-35(39)16-11-26-21-33(41-6)36(40)34(22-26)42-7/h11-12,16,21-22,24-25,28-32,40H,8-10,13-15,17-20,23H2,1-7H3/b16-11+/t25-,28?,29?,30-,31?,32?,37+,38-/m1/s1 |
| InChIKey | RMVGHZDUWZMSSU-BVHCTOKPSA-N |
| Mol Weight | 592.9 g/mol |
| Molecular Formula | C38H56O5 |
| Exact Mass | 592.412775 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | Be3LrF2PMma |
|---|---|
| Name | Cholesteryl - 4-Hydroxy-3,5-dimethoxycinnamate |
| Alternate Name(s) | Cholest-5-en-3-yl (2E)-3-(4-hydroxy-3,5-dimethoxyphenyl)-2-propenoate |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C38H56O5 |
| InChI | InChI=1S/C38H56O5/c1-24(2)9-8-10-25(3)30-14-15-31-29-13-12-27-23-28(17-19-37(27,4)32(29)18-20-38(30,31)5)43-35(39)16-11-26-21-33(41-6)36(40)34(22-26)42-7/h11-12,16,21-22,24-25,28-32,40H,8-10,13-15,17-20,23H2,1-7H3/b16-11+/t25-,28?,29?,30-,31?,32?,37+,38-/m1/s1 |
| InChIKey | RMVGHZDUWZMSSU-BVHCTOKPSA-N |
| Molecular Weight | 592.861 g/mol |
| SMILES | Oc1c(cc(\C=C\C(OC2CC[C@@]3(C4CC[C@]5(C(C4CC=C3C2)CC[C@@]5([C@@](CCCC(C)C)(C)[H])[H])C)C)=O)cc1OC)OC |
| SPLASH | splash10-00di-1192000000-223f27ac889851eed3b6 |
| Source of Spectrum | X2-58-283-17 |
| Wiley ID | 1605821 |