SpectraBase Compound ID | 8t0XhkI2Osc |
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InChI | InChI=1S/C8H12S/c1-3-7-5-9-6-8(7)4-2/h3-4,7-8H,1-2,5-6H2/t7-,8+ |
InChIKey | SRDLQDCHTYEMCJ-OCAPTIKFSA-N |
Mol Weight | 140.24 g/mol |
Molecular Formula | C8H12S |
Exact Mass | 140.065972 g/mol |
SpectraBase Spectrum ID | AsDRkspsK1S |
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Name | cis-3,4-Divinyltetrahydrothiophene |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 140.065971560 u |
Formula | C8H12S |
InChI | InChI=1S/C8H12S/c1-3-7-5-9-6-8(7)4-2/h3-4,7-8H,1-2,5-6H2/t7-,8+ |
InChIKey | SRDLQDCHTYEMCJ-OCAPTIKFSA-N |
Molecular Weight | 140.244 g/mol |
SMILES | C1SC[C@]([C@]1(C=C)[H])(C=C)[H] |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.965454 |