| SpectraBase Compound ID | 8luw9fbA50K |
|---|---|
| InChI | InChI=1S/C11H10ClNO2/c1-2-3-7-15-11(14)13-10-6-4-5-9(12)8-10/h1,4-6,8H,3,7H2,(H,13,14) |
| InChIKey | CRLGDEAYHVPTLP-UHFFFAOYSA-N |
| Mol Weight | 223.66 g/mol |
| Molecular Formula | C11H10ClNO2 |
| Exact Mass | 223.040006 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Fa7ORkvx9WX |
|---|---|
| Name | Carbamic acid, (3-chlorophenyl)-, 3-butynyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 223.040006264 u |
| Formula | C11H10ClNO2 |
| InChI | InChI=1S/C11H10ClNO2/c1-2-3-7-15-11(14)13-10-6-4-5-9(12)8-10/h1,4-6,8H,3,7H2,(H,13,14) |
| InChIKey | CRLGDEAYHVPTLP-UHFFFAOYSA-N |
| Molecular Weight | 223.659 g/mol |
| SMILES | C(NC1=CC(Cl)=CC=C1)(OCCC#C)=O |