| SpectraBase Compound ID | 6dn4l1Z0Pc8 |
|---|---|
| InChI | InChI=1S/C13H16/c1-2-3-4-5-7-10-13-11-8-6-9-12-13/h6,8-9,11-12H,2-5H2,1H3 |
| InChIKey | MDKGOJZZRHBMQU-UHFFFAOYSA-N |
| Mol Weight | 172.27 g/mol |
| Molecular Formula | C13H16 |
| Exact Mass | 172.125201 g/mol |
Near Infrared (NIR) Spectrum
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| SpectraBase Spectrum ID | K4lSXWLQDSg |
|---|---|
| Name | Benzene, 1-heptynyl- |
| Comments | Window Material: QI |
| Copyright | Copyright © 1989, 1990-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C13H16 |
| InChI | InChI=1S/C13H16/c1-2-3-4-5-7-10-13-11-8-6-9-12-13/h6,8-9,11-12H,2-5H2,1H3 |
| InChIKey | MDKGOJZZRHBMQU-UHFFFAOYSA-N |
| Instrument Name | BRUKER IFS 88 |
| Purity | 98% |
| Sample Description | STATE=NEAT, LIQUID |
| Source of Spectrum | Prof. Buback, University of Goettingen, Germany |
| Technique | NIR |