![4-[[(4-chlorophenyl)methyl]amino]-4-oxobutanoic acid, o-tms](/api/spectrum/Ez7vtEqQME2/structure.png?h=300&w=458 "4-[[(4-chlorophenyl)methyl]amino]-4-oxobutanoic acid, o-tms")
| SpectraBase Compound ID | 3wnM6funjDS |
|---|---|
| InChI | InChI=1S/C14H20ClNO3Si/c1-20(2,3)19-14(18)9-8-13(17)16-10-11-4-6-12(15)7-5-11/h4-7H,8-10H2,1-3H3,(H,16,17) |
| InChIKey | HZVZPEFQSPQDIB-UHFFFAOYSA-N |
| Mol Weight | 313.86 g/mol |
| Molecular Formula | C14H20ClNO3Si |
| Exact Mass | 313.090098 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Ez7vtEqQME2 |
|---|---|
| Name | 4-[[(4-chlorophenyl)methyl]amino]-4-oxobutanoic acid, o-tms |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 313.090097740 u |
| Formula | C14H20ClNO3Si |
| InChI | InChI=1S/C14H20ClNO3Si/c1-20(2,3)19-14(18)9-8-13(17)16-10-11-4-6-12(15)7-5-11/h4-7H,8-10H2,1-3H3,(H,16,17) |
| InChIKey | HZVZPEFQSPQDIB-UHFFFAOYSA-N |
| Molecular Weight | 313.856 g/mol |
| SMILES | C(NC(CCC(O[Si](C)(C)C)=O)=O)C1=CC=C(C=C1)Cl |