SpectraBase Compound ID | I5Pvxs8a1U |
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InChI | InChI=1S/C10H15Br/c1-6-7-10(11)8(2,3)9(10,4)5/h1-5H3 |
InChIKey | NIGPDTPDUAQPHA-UHFFFAOYSA-N |
Mol Weight | 215.13 g/mol |
Molecular Formula | C10H15Br |
Exact Mass | 214.035713 g/mol |
SpectraBase Spectrum ID | HnNoHPnqocq |
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Name | Cyclopropane, 1-bromo-2,2,3,3-tetramethyl-1-prop-1-ynyl- |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 214.035713483 u |
Formula | C10H15Br |
InChI | InChI=1S/C10H15Br/c1-6-7-10(11)8(2,3)9(10,4)5/h1-5H3 |
InChIKey | NIGPDTPDUAQPHA-UHFFFAOYSA-N |
Molecular Weight | 215.134 g/mol |
SMILES | C1(C(Br)(C#CC)C1(C)C)(C)C |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.867632 |