| SpectraBase Spectrum ID |
2LmV3663KIU |
| Name |
(-)-(3E,6S,7S,10S)-3,7,11-Trimethyldodeca-1,3-diene-6,7,10,11-tetraol |
| Comments |
Note: The molecular formula of the structure shown is C15H28O4 - which differs from the formula reported for the mass spectrum (C21H36O4) |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H36O4 |
| InChI |
InChI=1S/C15H28O4/c1-6-11(2)7-8-13(17)15(5,19)10-9-12(16)14(3,4)18/h6-7,12-13,16-19H,1,8-10H2,2-5H3/b11-7+/t12-,13-,15-/m0/s1 |
| InChIKey |
JYCDHRMLCUDMCF-BHAJWKKYSA-N |
| Molecular Weight |
272.385 g/mol |
| SMILES |
OC([C@](CC[C@@]([C@](C\C=C/(C)C=C)(O)[H])(O)C)(O)[H])(C)C |
| SPLASH |
splash10-0a4r-5924000000-425506c45ca5cc1418ac |
| Source of Spectrum |
SO-0-119-8 |
| Wiley ID |
873153 |
