| SpectraBase Compound ID | 9M2RcXVjtVD |
|---|---|
| InChI | InChI=1S/C7H14O/c1-2-3-4-5-6-7-8/h7H,2-6H2,1H3 |
| InChIKey | FXHGMKSSBGDXIY-UHFFFAOYSA-N |
| Mol Weight | 114.19 g/mol |
| Molecular Formula | C7H14O |
| Exact Mass | 114.104465 g/mol |
Near Infrared (NIR) Spectrum
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| SpectraBase Spectrum ID | Ip3G6R8OdpR |
|---|---|
| Name | Heptanal |
| Comments | Window Material: QI |
| Copyright | Copyright © 1989, 1990-2025 Wiley-VCH GmbH. All Rights Reserved. |
| Formula | C7H14O |
| InChI | InChI=1S/C7H14O/c1-2-3-4-5-6-7-8/h7H,2-6H2,1H3 |
| InChIKey | FXHGMKSSBGDXIY-UHFFFAOYSA-N |
| Instrument Name | BRUKER IFS 88 |
| Purity | 97% |
| Sample Description | STATE=NEAT, LIQUID |
| Source of Spectrum | Prof. Buback, University of Goettingen, Germany |
| Technique | NIR Spectrometer= INSTRUMENT PARAMETERS=INST=BRUKER,RSN=19475,REO=2,CNM=HEI,ZFF=2 |