| SpectraBase Spectrum ID |
DtHDpP3U4lI |
| Name |
(3S)-3-[(1'R)-1'-p-Nitrobenzoyl-3'-methylbutyl]-8-methoxy-3,4-dihydroisocumarin |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C22H23NO7 |
| InChI |
InChI=1S/C22H23NO7/c1-13(2)11-18(29-21(24)14-7-9-16(10-8-14)23(26)27)19-12-15-5-4-6-17(28-3)20(15)22(25)30-19/h4-10,13,18-19H,11-12H2,1-3H3/t18?,19-/m0/s1 |
| InChIKey |
UNFUZFWYHRBMPH-GGYWPGCISA-N |
| Molecular Weight |
413.426 g/mol |
| SMILES |
C1(c2c(cccc2OC)C[C@](O1)(C(OC(c1ccc(N(=O)=O)cc1)=O)CC(C)C)[H])=O |
| SPLASH |
splash10-004m-2910100000-38bf1b324088cb048d08 |
| Source of Spectrum |
J-61-3185-7 |
| Wiley ID |
1375008 |
![(3S)-3-[(1'R)-1'-p-Nitrobenzoyl-3'-methylbutyl]-8-methoxy-3,4-dihydroisocumarin](/api/spectrum/DtHDpP3U4lI/structure.png?h=300&w=458 "(3S)-3-[(1'R)-1'-p-Nitrobenzoyl-3'-methylbutyl]-8-methoxy-3,4-dihydroisocumarin")
