| SpectraBase Spectrum ID |
PgKLclSfDz |
| Name |
dimethyl (2-2H1)biphenyl-3,4-dicarboxylate |
| Alternate Name(s) |
Dimethyl (2-deuterium)-biphenyl-3,4-dicarboxylate |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C16H13DO4 |
| InChI |
InChI=1S/C16H14O4/c1-19-15(17)13-9-8-12(10-14(13)16(18)20-2)11-6-4-3-5-7-11/h3-10H,1-2H3/i10D |
| InChIKey |
MINFPQZYHRBMNP-MMIHMFRQSA-N |
| Molecular Weight |
271.290 g/mol |
| SMILES |
c1(c(c(ccc1C(=O)OC)-c1ccccc1)[D])C(=O)OC |
| SPLASH |
splash10-00di-0090000000-8740910c16fa9978e9d0 |
| Source of Spectrum |
JA-50-1159-0 |
| Wiley ID |
1274388 |
