| SpectraBase Spectrum ID |
FHLebB8FWNB |
| Name |
(2R,6S,8S)-2-((Benzyloxy)methyl)-8-((hydroxy)methyl)-1,7-dioxaspiro[5.5]undecan-4-one |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
320.162373868 u |
| Formula |
C18H24O5 |
| InChI |
InChI=1S/C18H24O5/c19-11-16-7-4-8-18(22-16)10-15(20)9-17(23-18)13-21-12-14-5-2-1-3-6-14/h1-3,5-6,16-17,19H,4,7-13H2/t16-,17+,18-/m0/s1 |
| InChIKey |
NTRQUUHTFGKZPJ-KSZLIROESA-N |
| Molecular Weight |
320.385 g/mol |
| SMILES |
[C@]12(O[C@@](COCC3=CC=CC=C3)(CC(=O)C1)[H])O[C@](CO)(CCC2)[H] |
![(2R,6S,8S)-2-((Benzyloxy)methyl)-8-((hydroxy)methyl)-1,7-dioxaspiro[5.5]undecan-4-one](/api/spectrum/FHLebB8FWNB/structure.png?h=300&w=458 "(2R,6S,8S)-2-((Benzyloxy)methyl)-8-((hydroxy)methyl)-1,7-dioxaspiro[5.5]undecan-4-one")
