| SpectraBase Compound ID | AeI9hXncc8 |
|---|---|
| InChI | InChI=1S/C13H18ClN3O3/c1-10(14)3-4-11(17-8-15-7-16-17)12(18)13(2)5-19-9-20-6-13/h3,7-8,11H,4-6,9H2,1-2H3/b10-3- |
| InChIKey | PCEWLUSESSIVRR-KMKOMSMNSA-N |
| Mol Weight | 299.76 g/mol |
| Molecular Formula | C13H18ClN3O3 |
| Exact Mass | 299.103669 g/mol |
Transmission Infrared (IR) Spectrum
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| SpectraBase Spectrum ID | 6aWmBB1vD2C |
|---|---|
| Name | 4-Hexen-1-one, 5-chloro-1-(5-methyl-1,3-dioxan-5-yl)-2-(1H-1,2,4-triazol-1-yl)-, (+/-)- |
| CAS Registry Number | 110858-19-0 |
| Copyright | Copyright © 1989, 1990-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C13H18ClN3O3 |
| InChI | InChI=1S/C13H18ClN3O3/c1-10(14)3-4-11(17-8-15-7-16-17)12(18)13(2)5-19-9-20-6-13/h3,7-8,11H,4-6,9H2,1-2H3/b10-3- |
| InChIKey | PCEWLUSESSIVRR-KMKOMSMNSA-N |
| Instrument Name | Bruker IFS 85 |
| Technique | Film |