| SpectraBase Compound ID | HB5VCJbGrGl |
|---|---|
| InChI | InChI=1S/C30H46O2/c1-19(2)20(3)8-9-21(4)26-12-13-27-25-11-10-23-18-24(32-22(5)31)14-16-29(23,6)28(25)15-17-30(26,27)7/h8-11,18-21,24-28H,12-17H2,1-7H3/b9-8+ |
| InChIKey | RSFACDGQBNMSJG-CMDGGOBGSA-N |
| Mol Weight | 438.7 g/mol |
| Molecular Formula | C30H46O2 |
| Exact Mass | 438.349781 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | G1x0dqTqC0O |
|---|---|
| Name | (22E)-Ergosta-4,6,22-trien-3-yl acetate |
| Alternate Name(s) | 3.beta.-Acetoxyergosta-4,6,22-triene Acetic acid [17-[(E)-5,6-dimethylhept-3-en-2-yl]-10,13-dimethyl-2,3,8,9,11,12,14,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-3-yl] ester [17-[(E)-5,6-dimethylhept-3-en-2-yl]-10,13-dimethyl-2,3,8,9,11,12,14,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-3-yl] acetate [10,13-dimethyl-17-[(E)-1,4,5-trimethylhex-2-enyl]-2,3,8,9,11,12,14,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-3-yl] acetate [17-[(E)-5,6-dimethylhept-3-en-2-yl]-10,13-dimethyl-2,3,8,9,11,12,14,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-3-yl] ethanoate |
| CAS Registry Number | 96737-73-4 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C30H46O2 |
| InChI | InChI=1S/C30H46O2/c1-19(2)20(3)8-9-21(4)26-12-13-27-25-11-10-23-18-24(32-22(5)31)14-16-29(23,6)28(25)15-17-30(26,27)7/h8-11,18-21,24-28H,12-17H2,1-7H3/b9-8+ |
| InChIKey | RSFACDGQBNMSJG-CMDGGOBGSA-N |
| Molecular Weight | 438.696 g/mol |
| SMILES | CC(C)C(C)\C=C\C(C)C1CCC2C3C=CC4=CC(CCC4(C)C3CCC12C)OC(C)=O |
| SPLASH | splash10-0691-6913000000-4e9fe6b6c107a8a7ffe2 |
| Source of Spectrum | W5-1989-38399-27137 |
| Wiley ID | 1384324 |