SpectraBase Compound ID | IxPzszwP8iu |
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InChI | InChI=1S/C11H19I/c1-2-3-4-5-6-7-8-9-10-11-12/h9,11H,2-8H2,1H3 |
InChIKey | PWHFLEAGPLCQNV-UHFFFAOYSA-N |
Mol Weight | 278.18 g/mol |
Molecular Formula | C11H19I |
Exact Mass | 278.053146 g/mol |
SpectraBase Spectrum ID | LtBfGZn1kkC |
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Name | (+-)-1-iodo-1,2-undecadiene |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 278.053145612 u |
Formula | C11H19I |
InChI | InChI=1S/C11H19I/c1-2-3-4-5-6-7-8-9-10-11-12/h9,11H,2-8H2,1H3 |
InChIKey | PWHFLEAGPLCQNV-UHFFFAOYSA-N |
Molecular Weight | 278.177 g/mol |
SMILES | C(=C=CCCCCCCCC)I |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.89488 |