| SpectraBase Spectrum ID |
KvLxRGLVjGA |
| Name |
13-hydroxy-17-nor-8,9-secolabdan-8-oic acid |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C19H36O3 |
| InChI |
InChI=1S/C19H36O3/c1-6-19(5,22)14-8-13-18(4)12-7-11-17(2,3)15(18)9-10-16(20)21/h15,22H,6-14H2,1-5H3,(H,20,21)/t15?,18-,19?/m1/s1 |
| InChIKey |
XOERDFWEZUQVQS-ZCDLSOSASA-N |
| Molecular Weight |
312.494 g/mol |
| SMILES |
OC(CCC[C@@]1(C(CCC(=O)O)C(CCC1)(C)C)C)(CC)C |
| SPLASH |
splash10-0006-0092000000-15c334ce1c25d5f659a8 |
| Source of Spectrum |
B-44-433-0 |
| Synonyms |
3-[(2R)-2-(4-hydroxy-4-methylhexyl)-2,6,6-trimethylcyclohexyl]propanoic acid
3-[(R)-2-(4-Hydroxy-4-methyl-hexyl)-2,6,6-trimethyl-cyclohexyl]-propionic acid |
| Wiley ID |
1313650 |
