| SpectraBase Compound ID | Ka3NJpumgQ |
|---|---|
| InChI | InChI=1S/C14H21ClO2/c1-3-5-9-16-12-7-8-14(13(15)11-12)17-10-6-4-2/h7-8,11H,3-6,9-10H2,1-2H3 |
| InChIKey | YXZPUUPBQVIBTL-UHFFFAOYSA-N |
| Mol Weight | 256.77 g/mol |
| Molecular Formula | C14H21ClO2 |
| Exact Mass | 256.123008 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | AiIS3oLVPaL |
|---|---|
| Name | 1,4-Dibutoxy-2-chlorobenzene |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 256.123007614 u |
| Formula | C14H21ClO2 |
| InChI | InChI=1S/C14H21ClO2/c1-3-5-9-16-12-7-8-14(13(15)11-12)17-10-6-4-2/h7-8,11H,3-6,9-10H2,1-2H3 |
| InChIKey | YXZPUUPBQVIBTL-UHFFFAOYSA-N |
| Molecular Weight | 256.773 g/mol |
| SMILES | C1(=C(C=C(C=C1)OCCCC)Cl)OCCCC |