![(E)-4-(1-Chloro-1,1,2,2,3,3-hextafluoropropyl)-7-methyl-2H-pyrido[1,2-a]pyrimidin-2-one](/api/spectrum/4AsBuM79e8S/structure.png?h=300&w=458 "(E)-4-(1-Chloro-1,1,2,2,3,3-hextafluoropropyl)-7-methyl-2H-pyrido[1,2-a]pyrimidin-2-one")
| SpectraBase Compound ID | 4kqOtpBuY3e |
|---|---|
| InChI | InChI=1S/C12H7ClF6N2O/c1-6-2-3-21-8(4-6)20-7(5-9(21)22)10(14,15)11(16,17)12(13,18)19/h2-5H,1H3 |
| InChIKey | GUJBEKROJANNAU-UHFFFAOYSA-N |
| Mol Weight | 344.64 g/mol |
| Molecular Formula | C12H7ClF6N2O |
| Exact Mass | 344.01511 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 4AsBuM79e8S |
|---|---|
| Name | (E)-4-(1-Chloro-1,1,2,2,3,3-hextafluoropropyl)-7-methyl-2H-pyrido[1,2-a]pyrimidin-2-one |
| Alternate Name(s) | (E)-4-(1-Chloro-1,1,2,2,3,3-hexafluoropropyl)-7-methyl-2H-pyrido[1,2-a]pyrimidin-2-one 2-(3-Chloro-1,1,2,2,3,3-hexafluoropropyl)-8-methyl-4-pyrido[1,2-a]pyrimidinone 2-(3-Chloro-1,1,2,2,3,3-hexafluoropropyl)-8-methylpyrido[1,2-a]pyrimidin-4-one 2-[3-chloranyl-1,1,2,2,3,3-hexakis(fluoranyl)propyl]-8-methyl-pyrido[1,2-a]pyrimidin-4-one |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C12H7ClF6N2O |
| InChI | InChI=1S/C12H7ClF6N2O/c1-6-2-3-21-8(4-6)20-7(5-9(21)22)10(14,15)11(16,17)12(13,18)19/h2-5H,1H3 |
| InChIKey | GUJBEKROJANNAU-UHFFFAOYSA-N |
| Molecular Weight | 344.644 g/mol |
| SMILES | C(C(C(F)(F)Cl)(F)F)(C=1N=C2C=C(C)C=CN2C(C1)=O)(F)F |
| SPLASH | splash10-001i-0809000000-3e1a3087bbddaa99cea9 |
| Source of Spectrum | KC-0-985-3 |
| Wiley ID | 787833 |