![2-Imidazoline-4-carboxylic acid, 1-(8-hydroxymethyl-3,3-dimethyl-2,4,7-trioxabicyclo[3.3.0]oct-6-yl)-5-imino-, ethyl ester](/api/spectrum/CLaihYXsgsM/structure.png?h=300&w=458 "2-Imidazoline-4-carboxylic acid, 1-(8-hydroxymethyl-3,3-dimethyl-2,4,7-trioxabicyclo[3.3.0]oct-6-yl)-5-imino-, ethyl ester")
| SpectraBase Compound ID | IMBAg7lOORW |
|---|---|
| InChI | InChI=1S/C14H21N3O6/c1-4-20-13(19)8-11(15)17(6-16-8)12-10-9(7(5-18)21-12)22-14(2,3)23-10/h6-10,12,15,18H,4-5H2,1-3H3 |
| InChIKey | GRHWVLBHUVSZLO-UHFFFAOYSA-N |
| Mol Weight | 327.34 g/mol |
| Molecular Formula | C14H21N3O6 |
| Exact Mass | 327.143035 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | CLaihYXsgsM |
|---|---|
| Name | 2-Imidazoline-4-carboxylic acid, 1-(8-hydroxymethyl-3,3-dimethyl-2,4,7-trioxabicyclo[3.3.0]oct-6-yl)-5-imino-, ethyl ester |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C14H21N3O6 |
| InChI | InChI=1S/C14H21N3O6/c1-4-20-13(19)8-11(15)17(6-16-8)12-10-9(7(5-18)21-12)22-14(2,3)23-10/h6-10,12,15,18H,4-5H2,1-3H3 |
| InChIKey | GRHWVLBHUVSZLO-UHFFFAOYSA-N |
| Molecular Weight | 327.337 g/mol |
| SMILES | N=C1C(N=CN1C1C2C(C(CO)O1)OC(O2)(C)C)C(OCC)=O |
| SPLASH | splash10-0a4i-9500000000-73eb39ffb9af10138d49 |
| Source of Spectrum | AD-0-2532-0 |
| Synonyms | 1-(2,2-dimethyl-6-methylol-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-4-yl)-5-imino-2-imidazoline-4-carboxylic acid ethyl ester 1-[6-(hydroxymethyl)-2,2-dimethyl-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-4-yl]-5-imino-4H-imidazole-4-carboxylic acid ethyl ester Ethyl 1-[6-(hydroxymethyl)-2,2-dimethyl-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-4-yl]-5-imino-4H-imidazole-4-carboxylate Ethyl 5-azanylidene-1-[6-(hydroxymethyl)-2,2-dimethyl-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-4-yl]-4H-imidazole-4-carboxylate |
| Wiley ID | 1428349 |