SpectraBase Compound ID | IWOVnJ898s6 |
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InChI | InChI=1S/C12H24Cl2/c1-2-3-4-5-6-7-8-9-10-12(14)11-13/h12H,2-11H2,1H3 |
InChIKey | HMBLILXCOAXXCR-UHFFFAOYSA-N |
Mol Weight | 239.23 g/mol |
Molecular Formula | C12H24Cl2 |
Exact Mass | 238.125506 g/mol |
SpectraBase Spectrum ID | F5ckz6QCnuJ |
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Name | 1,2-Dichlorododecane |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 238.125506173 u |
Formula | C12H24Cl2 |
InChI | InChI=1S/C12H24Cl2/c1-2-3-4-5-6-7-8-9-10-12(14)11-13/h12H,2-11H2,1H3 |
InChIKey | HMBLILXCOAXXCR-UHFFFAOYSA-N |
Molecular Weight | 239.230 g/mol |
SMILES | C(CCC(CCl)Cl)CCCCCCC |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.855411 |