| SpectraBase Spectrum ID |
I4fsCW6VZLB |
| Name |
(3S,9R,9aS)-3-(pivaloyloxymethyl)-2,3,5,6,7,8,9,9a-octahydro-1H-pyrrol[1,2-a]azepine-9-carboxylic acid methyl ester |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C17H29NO4 |
| InChI |
InChI=1S/C17H29NO4/c1-17(2,3)16(20)22-11-12-8-9-14-13(15(19)21-4)7-5-6-10-18(12)14/h12-14H,5-11H2,1-4H3/t12-,13+,14-/m0/s1 |
| InChIKey |
NCUIPEWTODOXPK-MJBXVCDLSA-N |
| Molecular Weight |
311.422 g/mol |
| SMILES |
[C@@]12(N(CCCC[C@]2(C(=O)OC)[H])[C@@](CC1)(COC(C(C)(C)C)=O)[H])[H] |
| SPLASH |
splash10-0002-1900000000-11af3a3c67bbb4b711d8 |
| Source of Spectrum |
F-70-3164-23 |
| Synonyms |
(3S,9R,9aS)-3-[(2,2-dimethyl-1-oxopropoxy)methyl]-2,3,5,6,7,8,9,9a-octahydro-1H-pyrrolo[1,2-a]azepine-9-carboxylic acid methyl ester
Methyl (3S,9R,9aS)-3-(2,2-dimethylpropanoyloxymethyl)-2,3,5,6,7,8,9,9a-octahydro-1H-pyrrolo[1,2-a]azepine-9-carboxylate |
| Wiley ID |
1596666 |
![(3S,9R,9aS)-3-(pivaloyloxymethyl)-2,3,5,6,7,8,9,9a-octahydro-1H-pyrrol[1,2-a]azepine-9-carboxylic acid methyl ester](/api/spectrum/I4fsCW6VZLB/structure.png?h=300&w=458 "(3S,9R,9aS)-3-(pivaloyloxymethyl)-2,3,5,6,7,8,9,9a-octahydro-1H-pyrrol[1,2-a]azepine-9-carboxylic acid methyl ester")
