| SpectraBase Compound ID | 2FwAZRJM6au |
|---|---|
| InChI | InChI=1S/C11H13NO3/c1-8(11(14)15-2)12-10(13)9-6-4-3-5-7-9/h3-8H,1-2H3,(H,12,13)/t8-/m0/s1/i8D |
| InChIKey | QRDFLIILGVFYCF-ZXEPEWCSSA-N |
| Mol Weight | 208.24 g/mol |
| Molecular Formula | C11H122DNO3 |
| Exact Mass | 208.09582 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | LVxfOQK48KJ |
|---|---|
| Name | N-Benzoyl-(2-deuterio)alanine - methyl ester |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C11H12DNO3 |
| InChI | InChI=1S/C11H13NO3/c1-8(11(14)15-2)12-10(13)9-6-4-3-5-7-9/h3-8H,1-2H3,(H,12,13)/t8-/m0/s1/i8D |
| InChIKey | QRDFLIILGVFYCF-ZXEPEWCSSA-N |
| Molecular Weight | 208.235 g/mol |
| SMILES | N(C(=O)c1ccccc1)[C@](C(=O)OC)(C)[2D] |
| SPLASH | splash10-0a4i-0900000000-9179c1bafbdd4051af58 |
| Source of Spectrum | B-53-555-1 |
| Wiley ID | 746960 |