SpectraBase Spectrum ID |
K0ZBqBkIf77 |
Name |
Ethyl [1-(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/i9+1 |
InChIKey |
MTNKPBYWJDVJMA-QBZHADDCSA-N |
Literature Reference DOI |
10.1002/cbic.201402298 |
Molecular Weight |
217.269 g/mol |
SMILES |
CC1(COC(OC1)(C[13C](=O)OCC)C)C |
SPLASH |
splash10-0ftf-9710000000-c0ef22a22f6161d0b05b |
Source of Spectrum |
CBC-15-2379/SM7-18b |
Synonyms |
Ethyl 2-(2,5,5-trimethyl-1,3-dioxan-2-yl)acetate-1-¹³C |
Wiley ID |
1786819 |