![Benzoic acid, 4-(tetrahydro-5,5,7,7-tetramethyl-2-oxopyrrolo[1,2-b][1,2,4]oxadiazol-1(2H)-yl)-, ethyl ester](/api/spectrum/EvhDv2lPzEp/structure.png?h=300&w=458 "Benzoic acid, 4-(tetrahydro-5,5,7,7-tetramethyl-2-oxopyrrolo[1,2-b][1,2,4]oxadiazol-1(2H)-yl)-, ethyl ester")
| SpectraBase Compound ID | LYeJgCGYMmJ |
|---|---|
| InChI | InChI=1S/C18H24N2O4/c1-6-23-14(21)12-7-9-13(10-8-12)19-15-17(2,3)11-18(4,5)20(15)24-16(19)22/h7-10,15H,6,11H2,1-5H3 |
| InChIKey | RJXAQNKVPTZWJF-UHFFFAOYSA-N |
| Mol Weight | 332.4 g/mol |
| Molecular Formula | C18H24N2O4 |
| Exact Mass | 332.173607 g/mol |
Mass Spectrum (GC)
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | EvhDv2lPzEp |
|---|---|
| Name | Benzoic acid, 4-(tetrahydro-5,5,7,7-tetramethyl-2-oxopyrrolo[1,2-b][1,2,4]oxadiazol-1(2H)-yl)-, ethyl ester |
| CAS Registry Number | 39931-32-3 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C18H24N2O4 |
| InChI | InChI=1S/C18H24N2O4/c1-6-23-14(21)12-7-9-13(10-8-12)19-15-17(2,3)11-18(4,5)20(15)24-16(19)22/h7-10,15H,6,11H2,1-5H3 |
| InChIKey | RJXAQNKVPTZWJF-UHFFFAOYSA-N |
| Molecular Weight | 332.400 g/mol |
| SMILES | CCOC(c1ccc(cc1)N1C2C(C)(C)CC(C)(C)N2OC1=O)=O |
| SPLASH | splash10-000t-9600000000-270ec56b6f67a32e81a2 |
| Source of Spectrum | B-26-2486-16 |
| Synonyms | Ethyl 4-(5,5,7,7-tetramethyl-2-oxotetrahydropyrrolo[1,2-b][1,2,4]oxadiazol-1(2H)-yl)benzoate 4-(2-keto-5,5,7,7-tetramethyl-6,7a-dihydropyrrolo[1,2-b][1,2,4]oxadiazol-1-yl)benzoic acid ethyl ester 4-(5,5,7,7-tetramethyl-2-oxo-6,7a-dihydropyrrolo[1,2-b][1,2,4]oxadiazol-1-yl)benzoic acid ethyl ester Ethyl 4-(5,5,7,7-tetramethyl-2-oxidanylidene-6,7a-dihydropyrrolo[1,2-b][1,2,4]oxadiazol-1-yl)benzoate Ethyl 4-(5,5,7,7-tetramethyl-2-oxo-6,7a-dihydropyrrolo[1,2-b][1,2,4]oxadiazol-1-yl)benzoate |
| Wiley ID | 1329379 |