| SpectraBase Compound ID | 2fV5Yg01QQp |
|---|---|
| InChI | InChI=1S/C17H21NO3Si/c1-12-10-15(11-19)13(2)18(12)16-8-6-14(7-9-16)17(20)21-22(3,4)5/h6-11H,1-5H3 |
| InChIKey | LDODOLAJKHNIDG-UHFFFAOYSA-N |
| Mol Weight | 315.44 g/mol |
| Molecular Formula | C17H21NO3Si |
| Exact Mass | 315.12907 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | AVAstSw5VI6 |
|---|---|
| Name | 4-(3-Formyl-2,5-dimethyl-1H-pyrrol-1-yl)benzoic acid, o-tms |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 315.129070072 u |
| Formula | C17H21NO3Si |
| InChI | InChI=1S/C17H21NO3Si/c1-12-10-15(11-19)13(2)18(12)16-8-6-14(7-9-16)17(20)21-22(3,4)5/h6-11H,1-5H3 |
| InChIKey | LDODOLAJKHNIDG-UHFFFAOYSA-N |
| SMILES | CC=1N(C(C)=CC1C=O)C1=CC=C(C=C1)C(O[Si](C)(C)C)=O |