| SpectraBase Spectrum ID |
JRi5HDB5fjU |
| Name |
6-[[N-[2-(Hydroxymethyl)-3,3-dimethylbutyl]-N-methylamino]methyl]-2-[[[(3-benzyloxy)propoxy]methoxy]methyl]-4,4-dimethylcyclohexane-1-ol |
| Comments |
Removed - expert review: contamination (acetone)) |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C29H51NO5 |
| InChI |
InChI=1S/C29H51NO5/c1-28(2,3)26(19-31)18-30(6)17-24-15-29(4,5)16-25(27(24)32)21-35-22-34-14-10-13-33-20-23-11-8-7-9-12-23/h7-9,11-12,24-27,31-32H,10,13-22H2,1-6H3/t24-,25+,26?,27+/m0/s1 |
| InChIKey |
VEESSAHWASIUBL-SMVCDJAZSA-N |
| Molecular Weight |
493.729 g/mol |
| SMILES |
O[C@@]1([C@](CN(CC(CO)C(C)(C)C)C)(CC(C[C@@]1(COCOCCCOCc1ccccc1)[H])(C)C)[H])[H] |
| SPLASH |
splash10-0a4i-9000000000-e11a0378bef4a5eec60d |
| Source of Spectrum |
J-63-2559-27 |
| Synonyms |
(1R,2R,6S)-6-[[N-[2-(Hydroxymethyl)-3,3-dimethylbutyl]-N-methylamino]methyl]-2-[[[(3-benzyloxy)propoxy]methoxy]methyl]-4,4-dimethylcyclohexane-1-ol
2-({[3-(benzyloxy)propoxy]methoxy}methyl)-6-{[[2-(hydroxymethyl)-3,3-dimethylbutyl](methyl)amino]methyl}-4,4-dimethylcyclohexanol |
| Wiley ID |
1397742 |
![6-[[N-[2-(Hydroxymethyl)-3,3-dimethylbutyl]-N-methylamino]methyl]-2-[[[(3-benzyloxy)propoxy]methoxy]methyl]-4,4-dimethylcyclohexane-1-ol](/api/spectrum/JRi5HDB5fjU/structure.png?h=300&w=458 "6-[[N-[2-(Hydroxymethyl)-3,3-dimethylbutyl]-N-methylamino]methyl]-2-[[[(3-benzyloxy)propoxy]methoxy]methyl]-4,4-dimethylcyclohexane-1-ol")
