SpectraBase Compound ID | C2UVWUQwgP5 |
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InChI | InChI=1S/C11H14OS/c1-3-9-12-10-7-5-6-8-11(10)13-4-2/h3,5-8H,1,4,9H2,2H3 |
InChIKey | KNCSQFHZRKBQOF-UHFFFAOYSA-N |
Mol Weight | 194.29 g/mol |
Molecular Formula | C11H14OS |
Exact Mass | 194.076536 g/mol |
SpectraBase Spectrum ID | 5Oi0ZCHPimc |
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Name | Benzene, 1-(ethylthio)-2-(2-propenyloxy)- |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 194.076536244 u |
Formula | C11H14OS |
InChI | InChI=1S/C11H14OS/c1-3-9-12-10-7-5-6-8-11(10)13-4-2/h3,5-8H,1,4,9H2,2H3 |
InChIKey | KNCSQFHZRKBQOF-UHFFFAOYSA-N |
Molecular Weight | 194.292 g/mol |
SMILES | C=1(C(OCC=C)=CC=CC1)SCC |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.861091 |