| SpectraBase Spectrum ID |
58X2UbxPrE |
| Name |
Ethyl [3-(13)C]-2-(2,5,5-trimethyl-1,3-dioxan-2-yl)acetate |
| Comments |
Original formula: C10[13C]H20O4 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C11H20O4 |
| InChI |
InChI=1S/C11H20O4/c1-5-13-9(12)6-11(4)14-7-10(2,3)8-15-11/h5-8H2,1-4H3/i11+1 |
| InChIKey |
MTNKPBYWJDVJMA-KHWBWMQUSA-N |
| Literature Reference DOI |
10.1002/cbic.201402298 |
| Molecular Weight |
217.269 g/mol |
| SMILES |
CC1(CO[13C](OC1)(CC(=O)OCC)C)C |
| SPLASH |
splash10-001l-9620000000-847b4108f2f7fb157ef7 |
| Source of Spectrum |
CBC-15-2379/SM7-18a |
| Synonyms |
Ethyl 2-(2,5,5-trimethyl-1,3-dioxan-2-yl-2-¹³C)acetate |
| Wiley ID |
1786818 |
