| SpectraBase Compound ID | FXXD4ph0nT8 |
|---|---|
| InChI | InChI=1S/C32H54O2/c1-7-8-12-30(33)34-25-17-19-31(5)24(21-25)13-14-26-28-16-15-27(23(4)11-9-10-22(2)3)32(28,6)20-18-29(26)31/h13,22-23,25-29H,7-12,14-21H2,1-6H3/t23?,25-,26-,27+,28-,29?,31-,32+/m0/s1 |
| InChIKey | RWTQCZGAMKTBRV-VAAXQIOFSA-N |
| Mol Weight | 470.8 g/mol |
| Molecular Formula | C32H54O2 |
| Exact Mass | 470.412381 g/mol |
Mass Spectrum (GC)
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 2klB6qY8nOC |
|---|---|
| Name | Cholesteryl valerate |
| CAS Registry Number | 7726-03-6 |
| Classification | Pharmaceutical drug, excipient |
| Copyright | Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass | 470.412380977 u |
| Formula | C32H54O2 |
| InChI | InChI=1S/C32H54O2/c1-7-8-12-30(33)34-25-17-19-31(5)24(21-25)13-14-26-28-16-15-27(23(4)11-9-10-22(2)3)32(28,6)20-18-29(26)31/h13,22-23,25-29H,7-12,14-21H2,1-6H3/t23?,25-,26-,27+,28-,29?,31-,32+/m0/s1 |
| InChIKey | RWTQCZGAMKTBRV-VAAXQIOFSA-N |
| Ionization Type | Electron Ionization (EI) |
| Molecular Weight | 470.782 g/mol |
| Nominal Mass | 470 u |
| Quality | 950 |
| Retention Index | 3573 |
| SMILES | [C@]12([C@]3(C([C@@]4(C(=CC3)C[C@](CC4)(OC(CCCC)=O)[H])C)CC[C@@]2([C@](CC1)(C(CCCC(C)C)C)[H])C)[H])[H] |
| SPLASH | splash10-014j-5923000000-37fadbd093c27f87349f |
| Source of Spectrum | DigiLab GmbH (C) 2024 |
| Technique | GC/MS |
| Wiley ID | DD2024_000703 |