| SpectraBase Spectrum ID |
Dss8R2yPfD |
| Name |
1,1-(Ethylenedioxy)-3-hydroxy-5-(methoxymethyl)-5-methylcycloheptane |
| Alternate Name(s) |
9-(methoxymethyl)-9-methyl-1,4-dioxaspiro[4.6]undecan-7-ol |
| CAS Registry Number |
80721-99-9 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C12H22O4 |
| InChI |
InChI=1S/C12H22O4/c1-11(9-14-2)3-4-12(8-10(13)7-11)15-5-6-16-12/h10,13H,3-9H2,1-2H3 |
| InChIKey |
BZUMIVNWLDZJJO-UHFFFAOYSA-N |
| Molecular Weight |
230.304 g/mol |
| SMILES |
OC1CC2(OCCO2)CCC(COC)(C)C1 |
| SPLASH |
splash10-014j-6900000000-0bd21c1dc066cd522107 |
| Source of Spectrum |
J-47-1390-0 |
| Wiley ID |
1231639 |
