| SpectraBase Compound ID | KwKFD76uo5T |
|---|---|
| InChI | InChI=1S/C8H17NOS/c1-8(2)11-7-9-3-5-10-6-4-9/h8H,3-7H2,1-2H3 |
| InChIKey | YXTBTNKSYWAUTA-UHFFFAOYSA-N |
| Mol Weight | 175.29 g/mol |
| Molecular Formula | C8H17NOS |
| Exact Mass | 175.103085 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | BbL07CYdwvc |
|---|---|
| Name | N-Morpholinomethyl-isopropyl-sulfide |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 175.103085344 u |
| Formula | C8H17NOS |
| InChI | InChI=1S/C8H17NOS/c1-8(2)11-7-9-3-5-10-6-4-9/h8H,3-7H2,1-2H3 |
| InChIKey | YXTBTNKSYWAUTA-UHFFFAOYSA-N |
| Molecular Weight | 175.290 g/mol |
| SMILES | C1N(CCOC1)CSC(C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.931001 |