| SpectraBase Spectrum ID |
4iqZDMt9ekV |
| Name |
(1R,4aR,5R,8aR)-6-formyl-1,4a-dimethyl-5-(4-methyl-3-oxo-pentyl)-2,3,4,5,8,8a-hexahydronaphthalene-1-carboxylic acid |
| CAS Registry Number |
104915-32-4 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C20H30O4 |
| InChI |
InChI=1S/C20H30O4/c1-13(2)16(22)8-7-15-14(12-21)6-9-17-19(15,3)10-5-11-20(17,4)18(23)24/h6,12-13,15,17H,5,7-11H2,1-4H3,(H,23,24)/t15-,17+,19+,20+/m0/s1 |
| InChIKey |
UCRJIYGYSLKACR-JQERWDHBSA-N |
| Molecular Weight |
334.456 g/mol |
| SMILES |
OC([C@]1([C@]2([C@@]([C@](C(=CC2)C=O)(CCC(=O)C(C)C)[H])(CCC1)C)[H])C)=O |
| SPLASH |
splash10-0ff3-0291000000-8ec8a9d26e6a14935bd7 |
| Source of Spectrum |
AH-116-1355-9 |
| Synonyms |
(1R,4aR,5R,8aR)-6-formyl-5-(3-keto-4-methyl-pentyl)-1,4a-dimethyl-2,3,4,5,8,8a-hexahydronaphthalene-1-carboxylic acid
(1R,4aR,5R,8aR)-6-methanoyl-1,4a-dimethyl-5-(4-methyl-3-oxidanylidene-pentyl)-2,3,4,5,8,8a-hexahydronaphthalene-1-carboxylic acid |
| Wiley ID |
1331115 |
