| SpectraBase Compound ID | KLQVkjV1wGH |
|---|---|
| InChI | InChI=1S/C14H19ClO2/c1-2-3-4-5-6-11-17-13-9-7-12(8-10-13)14(15)16/h7-10H,2-6,11H2,1H3 |
| InChIKey | OTHIDQZVUQAMEW-UHFFFAOYSA-N |
| Mol Weight | 254.76 g/mol |
| Molecular Formula | C14H19ClO2 |
| Exact Mass | 254.107358 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | K9L8KKVQ3fX |
|---|---|
| Name | 4-(Heptyloxy)benzoyl chloride |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 254.107357550 u |
| Formula | C14H19ClO2 |
| InChI | InChI=1S/C14H19ClO2/c1-2-3-4-5-6-11-17-13-9-7-12(8-10-13)14(15)16/h7-10H,2-6,11H2,1H3 |
| InChIKey | OTHIDQZVUQAMEW-UHFFFAOYSA-N |
| Molecular Weight | 254.757 g/mol |
| SMILES | C(C1=CC=C(C=C1)OCCCCCCC)(=O)Cl |