| SpectraBase Spectrum ID |
FVfFJWQV3ML |
| Name |
(S)-Diethyl (3-methoxy-4-methylsulphonyloxy(.alpha.-3H1)benzyl)malonate |
| Comments |
Original formula: C16H21[3H]O8S |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C16H22O8S |
| InChI |
InChI=1S/C16H22O8S/c1-5-22-15(17)12(16(18)23-6-2)9-11-7-8-13(14(10-11)21-3)24-25(4,19)20/h7-8,10,12H,5-6,9H2,1-4H3/i9T/t9-/m1/s1 |
| InChIKey |
OVACFBJUEISPMK-JUFFOISUSA-N |
| Molecular Weight |
376.412 g/mol |
| SMILES |
c1(OS(=O)(=O)C)c(cc([C@](C(C(=O)OCC)C(=O)OCC)([3H])[H])cc1)OC |
| SPLASH |
splash10-0002-0092000000-52eeef7203773ecc51a1 |
| Source of Spectrum |
KC-1976-1060-0 |
| Wiley ID |
1356390 |
