SpectraBase Compound ID | 90a5rHg2F4d |
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InChI | InChI=1S/C3H8OS/c1-4-3-5-2/h3H2,1-2H3 |
InChIKey | VAGATLLGFQHQAA-UHFFFAOYSA-N |
Mol Weight | 92.16 g/mol |
Molecular Formula | C3H8OS |
Exact Mass | 92.029586 g/mol |
SpectraBase Spectrum ID | 4E2kPCvIH6B |
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Name | Methoxy(methylsulfanyl)methane |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 92.029586051 u |
Formula | C3H8OS |
InChI | InChI=1S/C3H8OS/c1-4-3-5-2/h3H2,1-2H3 |
InChIKey | VAGATLLGFQHQAA-UHFFFAOYSA-N |
Molecular Weight | 92.156 g/mol |
SMILES | C(SC)OC |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.898539 |