| SpectraBase Compound ID | DBNCB4Zer5q |
|---|---|
| InChI | InChI=1S/C14H19ClO3/c1-10(9-17-14(2,3)4)18-13(16)11-7-5-6-8-12(11)15/h5-8,10H,9H2,1-4H3 |
| InChIKey | MCQGMGYMJDUQAH-UHFFFAOYSA-N |
| Mol Weight | 270.76 g/mol |
| Molecular Formula | C14H19ClO3 |
| Exact Mass | 270.102272 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Cm02oYqXyM2 |
|---|---|
| Name | 1-Tert-butoxypropan-2-yl 2-chlorobenzoate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 270.102272169 u |
| Formula | C14H19ClO3 |
| InChI | InChI=1S/C14H19ClO3/c1-10(9-17-14(2,3)4)18-13(16)11-7-5-6-8-12(11)15/h5-8,10H,9H2,1-4H3 |
| InChIKey | MCQGMGYMJDUQAH-UHFFFAOYSA-N |
| SMILES | CC(OCC(C)OC(C1=C(C=CC=C1)Cl)=O)(C)C |