| SpectraBase Compound ID | KClms6SMC3Y |
|---|---|
| InChI | InChI=1S/C6H12O/c1-3-5-6(7)4-2/h3-5H2,1-2H3 |
| InChIKey | PFCHFHIRKBAQGU-UHFFFAOYSA-N |
| Mol Weight | 100.16 g/mol |
| Molecular Formula | C6H12O |
| Exact Mass | 100.088815 g/mol |
Near Infrared (NIR) Spectrum
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| SpectraBase Spectrum ID | J6vIpfW6o3f |
|---|---|
| Name | 3-Hexanone |
| Comments | Window Material: QI |
| Copyright | Copyright © 1989, 1990-2025 Wiley-VCH GmbH. All Rights Reserved. |
| Formula | C6 H12 O |
| InChI | InChI=1S/C6H12O/c1-3-5-6(7)4-2/h3-5H2,1-2H3 |
| InChIKey | PFCHFHIRKBAQGU-UHFFFAOYSA-N |
| Instrument Name | INSTRUMENT PARAMETERS=INST=BRUKER,RSN=7565,REO=2,CNM=HEI,ZFF=2 |
| Purity | 96% |
| Sample Description | STATE=NEAT, LIQUID |
| Source of Spectrum | Prof. Buback, University of Goettingen, Germany |
| Technique | NIR Spectrometer= BRUKER IFS 88 |