| SpectraBase Spectrum ID |
6fGODil3mka |
| Name |
(2Z/E)-Methyl tetradeuteroABA |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C16H18D4O4 |
| InChI |
InChI=1S/C16H22O4/c1-11(8-14(18)20-5)6-7-16(19)12(2)9-13(17)10-15(16,3)4/h6-9,19H,10H2,1-5H3/b7-6+,11-8-/t16-/m1/s1/i1D3,6D |
| InChIKey |
HHDYPZVHXGPCRG-BLSMQVQDSA-N |
| Molecular Weight |
282.372 g/mol |
| SMILES |
O[C@@]1(C(=CC(=O)CC1(C)C)C)\C=C\(\C(=C/C(=O)OC)C([D])([D])[D])[D] |
| SPLASH |
splash10-0006-5900000000-fe8016a105ee85673b50 |
| Source of Spectrum |
AT-36-5799-6 |
| Wiley ID |
853285 |
