| SpectraBase Compound ID | AfoVyuiiqlf |
|---|---|
| InChI | InChI=1S/C16H17F3O3/c1-15(2)8-7-12(20)10-5-3-4-6-11(10)13(9-15)22-14(21)16(17,18)19/h3-6,13H,7-9H2,1-2H3 |
| InChIKey | VBRSVWXPHYYCAM-UHFFFAOYSA-N |
| Mol Weight | 314.3 g/mol |
| Molecular Formula | C16H17F3O3 |
| Exact Mass | 314.112979 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 2wtNdkBc8Fg |
|---|---|
| Name | Acetic acid, trifluoro-, 5,6,7,8,9,10-hexahydro-7,7-dimethyl-10-oxo-5-benzocyclooctenyl ester |
| CAS Registry Number | 64129-26-6 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C16H17F3O3 |
| InChI | InChI=1S/C16H17F3O3/c1-15(2)8-7-12(20)10-5-3-4-6-11(10)13(9-15)22-14(21)16(17,18)19/h3-6,13H,7-9H2,1-2H3 |
| InChIKey | VBRSVWXPHYYCAM-UHFFFAOYSA-N |
| Molecular Weight | 314.304 g/mol |
| SMILES | CC1(C)CCC(c2ccccc2C(C1)OC(C(F)(F)F)=O)=O |
| SPLASH | splash10-001i-0910000000-14f3b2bbfad166b4f2c7 |
| Source of Spectrum | C-99-5088-0 |
| Synonyms | 7,7-Dimethyl-10-oxo-5,6,7,8,9,10-hexahydrobenzo[a]cycloocten-5-yl trifluoroacetate (7,7-dimethyl-10-oxidanylidene-5,6,8,9-tetrahydrobenzo[8]annulen-5-yl) 2,2,2-tris(fluoranyl)ethanoate (7,7-dimethyl-10-oxo-5,6,8,9-tetrahydrobenzo[8]annulen-5-yl) 2,2,2-trifluoroacetate 2,2,2-trifluoroacetic acid (10-keto-7,7-dimethyl-5,6,8,9-tetrahydrobenzocycloocten-5-yl) ester 2,2,2-trifluoroacetic acid (7,7-dimethyl-10-oxo-5,6,8,9-tetrahydrobenzo[8]annulen-5-yl) ester |
| Wiley ID | 1314869 |