| SpectraBase Spectrum ID |
7i1w3i3p0eQ |
| Name |
(R/S)-(1-13C,1-2H2)-2-(2,5,5-Trimethyl-1,3-dioxan-2-yl)ethan-1-ol |
| Appearance |
colourless oil |
| Comments |
Original formula: C8[13C]H16D2O3 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C9H18O3 |
| InChI |
InChI=1S/C9H18O3/c1-8(2)6-11-9(3,4-5-10)12-7-8/h10H,4-7H2,1-3H3/i5+1D2 |
| InChIKey |
BZTYJEJBQGKZQZ-XCFCCHCNSA-N |
| Instrument Name |
Agilent 7890B-5977A |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/chem.201905827 |
| Molecular Weight |
177.245 g/mol |
| SMILES |
O[13C](CC1(OCC(C)(CO1)C)C)([D])[D] |
| SPLASH |
splash10-002f-9200000000-b1aecf174cd89d4f262b |
| Source of Spectrum |
QE-26-SM122-S14 |
| Thin-Layer Chromatography |
Rf = 0.25 (Cyclohexane/EA, 2/1) |
| Wiley ID |
1858525 |
