| SpectraBase Compound ID | 99HiDLrg8iu |
|---|---|
| InChI | InChI=1S/C8H15NS/c1-2-3-4-5-6-7-9-8-10/h2-7H2,1H3 |
| InChIKey | LIPUQNPCPLDDBO-UHFFFAOYSA-N |
| Mol Weight | 157.27 g/mol |
| Molecular Formula | C8H15NS |
| Exact Mass | 157.092521 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | EMzP7ASMPE0 |
|---|---|
| Name | ISOTHIOCYANIC ACID, HEPTYL ESTER |
| Source of Sample | Eastman Organic Chemicals, Rochester, New York |
| Boiling Point | 107-109C/10mm |
| Comments | Relaxation agent added |
| Copyright | Copyright © 1980, 1981-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C8H15NS |
| InChI | InChI=1S/C8H15NS/c1-2-3-4-5-6-7-9-8-10/h2-7H2,1H3 |
| InChIKey | LIPUQNPCPLDDBO-UHFFFAOYSA-N |
| Molecular Weight | 157.28 |
| Solvent | Chloroform-d; Reference=TMS Spectrometer= Varian CFT-20 |