SpectraBase Compound ID | EpI8iqDlvgl |
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InChI | InChI=1S/C6H11ClO/c7-5-1-2-6(8)3-4-6/h8H,1-5H2 |
InChIKey | PACSUMUBOSJKCI-UHFFFAOYSA-N |
Mol Weight | 134.61 g/mol |
Molecular Formula | C6H11ClO |
Exact Mass | 134.049843 g/mol |
SpectraBase Spectrum ID | 3kA5Y1GD36Y |
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Name | 1-(3-Chloropropyl)cyclopropanol |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 134.049842673 u |
Formula | C6H11ClO |
InChI | InChI=1S/C6H11ClO/c7-5-1-2-6(8)3-4-6/h8H,1-5H2 |
InChIKey | PACSUMUBOSJKCI-UHFFFAOYSA-N |
SMILES | C1(CC1)(O)CCCCl |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.815401 |