SpectraBase Compound ID | 6N4CnomkkTk |
---|---|
InChI | InChI=1S/C6H12FI/c1-4-5(8)6(2,3)7/h5H,4H2,1-3H3 |
InChIKey | LHLHLAPANQSRLM-UHFFFAOYSA-N |
Mol Weight | 230.06 g/mol |
Molecular Formula | C6H12FI |
Exact Mass | 229.996774 g/mol |
SpectraBase Spectrum ID | 4Ym7CD7a0I2 |
---|---|
Name | 2-Fluoro-3-iodo-2-methylpentane |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 229.996773549 u |
Formula | C6H12FI |
InChI | InChI=1S/C6H12FI/c1-4-5(8)6(2,3)7/h5H,4H2,1-3H3 |
InChIKey | LHLHLAPANQSRLM-UHFFFAOYSA-N |
Molecular Weight | 230.065 g/mol |
SMILES | C(F)(C)(C(I)CC)C |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.910494 |