| SpectraBase Compound ID | KbvyD6HU2O9 |
|---|---|
| InChI | InChI=1S/C22H28O3/c1-20-9-5-15(23)13-14(20)3-4-16-17(20)6-10-21(2)18(16)7-11-22(21)12-8-19(24)25-22/h3-4,13,16-18H,5-12H2,1-2H3/t16-,17+,18+,20+,21+,22-/m1/s1 |
| InChIKey | UJVLDDZCTMKXJK-WNHSNXHDSA-N |
| Mol Weight | 340.46 g/mol |
| Molecular Formula | C22H28O3 |
| Exact Mass | 340.203845 g/mol |
Attenuated Total Reflectance Infrared (ATR-IR) Spectrum
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| SpectraBase Spectrum ID | 4RbV6tuQCZC |
|---|---|
| Name | Aldadiene |
| Source of Sample | Steraloids Inc. |
| Catalog Number | P0960-000 |
| Lot Number | H527 |
| Accessory | DurasamplIR II |
| CAS Registry Number | 976-71-6 |
| Classification | Metabolite |
| Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C22H28O3 |
| InChI | InChI=1S/C22H28O3/c1-20-9-5-15(23)13-14(20)3-4-16-17(20)6-10-21(2)18(16)7-11-22(21)12-8-19(24)25-22/h3-4,13,16-18H,5-12H2,1-2H3/t16-,17+,18+,20+,21+,22-/m1/s1 |
| InChIKey | UJVLDDZCTMKXJK-WNHSNXHDSA-N |
| Instrument Name | Bio-Rad FTS |
| Source of Spectrum | Forensic Spectral Research |
| Technique | ATR-Neat (DuraSamplIR II) |