| SpectraBase Spectrum ID |
47cbGYVHtN7 |
| Name |
[1R*,2S*]-1-acetyl-2-(methoxycarbonyl)-3-cyclohexen-1-yl p-nitrobenzoate |
| CAS Registry Number |
111945-72-3 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C17H17NO7 |
| InChI |
InChI=1S/C17H17NO7/c1-11(19)17(10-4-3-5-14(17)16(21)24-2)25-15(20)12-6-8-13(9-7-12)18(22)23/h3,5-9,14H,4,10H2,1-2H3/t14-,17+/m1/s1 |
| InChIKey |
SVEDANSHTQEXJS-PBHICJAKSA-N |
| Molecular Weight |
347.323 g/mol |
| SMILES |
[C@]1([C@@](C(=O)OC)(C=CCC1)[H])(OC(c1ccc(N(=O)=O)cc1)=O)C(=O)C |
| SPLASH |
splash10-0udi-0900000000-7b0ab25d87dd286a8f09 |
| Source of Spectrum |
J-55-1033-22 |
| Synonyms |
(1R,2S)-1-acetyl-2-(methoxycarbonyl)-3-cyclohexen-1-yl 4-nitrobenzoate |
| Wiley ID |
1339949 |
![[1R*,2S*]-1-acetyl-2-(methoxycarbonyl)-3-cyclohexen-1-yl p-nitrobenzoate](/api/spectrum/47cbGYVHtN7/structure.png?h=300&w=458 "[1R*,2S*]-1-acetyl-2-(methoxycarbonyl)-3-cyclohexen-1-yl p-nitrobenzoate")
