| SpectraBase Compound ID | ESDX6yKuidf |
|---|---|
| InChI | InChI=1S/C21H28O2/c1-14(2)15-7-9-17-16(13-15)8-10-18-20(17,3)11-6-12-21(18,4)19(22)23-5/h7,9,13,18H,1,6,8,10-12H2,2-5H3/t18?,20-,21+/m1/s1 |
| InChIKey | BKCHVXPKTRKXKJ-HBYOEVMUSA-N |
| Mol Weight | 312.45 g/mol |
| Molecular Formula | C21H28O2 |
| Exact Mass | 312.20893 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | LwJfWu0pA4T |
|---|---|
| Name | Methyl RO15 - dehydro - abietate |
| CAS Registry Number | 22465-60-7 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C21H28O2 |
| InChI | InChI=1S/C21H28O2/c1-14(2)15-7-9-17-16(13-15)8-10-18-20(17,3)11-6-12-21(18,4)19(22)23-5/h7,9,13,18H,1,6,8,10-12H2,2-5H3/t18?,20-,21+/m1/s1 |
| InChIKey | BKCHVXPKTRKXKJ-HBYOEVMUSA-N |
| Molecular Weight | 312.453 g/mol |
| SMILES | [C@@]12(C([C@](C(=O)OC)(C)CCC2)CCc2c1ccc(C(=C)C)c2)C |
| SPLASH | splash10-000i-0392000000-17f5008652d3ad7c46ee |
| Source of Spectrum | Va-0-0-0 |
| Synonyms | Methyl RO15 - dehydro - abietate (Mills cpd. XIXb) - 13-isopropenyl-podocarpa-8,11,13-trien-15-oic acid, methyl ester (-)-13-isopropenyl-podocarpa-8,11,13-trien-15-oic acid, methyl ester Methyl 8,11,13,15-abieta-tetraen-18-oate Methyl (4alpha)-abieta-8,11,13,15(17)-tetraen-18-oate Methyl 8,11,13,15-abieta-tetraen-18-oate(-) [1R-(1.alpha.,4a.beta.,10a,alpha.)]- 1,2,3,4,4a,9,10,10a-octahydro-1,4a-dimethyl-7-(1-methylethenyl)-1-phenanthrene-carboxylic acid, methyl ester |
| Wiley ID | 741772 |