| SpectraBase Spectrum ID |
80TNSem4wmt |
| Name |
(3aR,6aS)-5-(1,3-benzodioxol-5-yl)-3-(2-chlorophenyl)-3aH-pyrrolo[3,4-d]isoxazole-4,6(5H,6aH)-dione |
| Author |
A.V.Yarkov, IPAC, Russia |
| Copyright |
Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved. |
| InChI |
InChI=1S/C18H11ClN2O5/c19-11-4-2-1-3-10(11)15-14-16(26-20-15)18(23)21(17(14)22)9-5-6-12-13(7-9)25-8-24-12/h1-7,14,16H,8H2 |
| InChIKey |
KXJMSGDMBNHJMB-UHFFFAOYSA-N |
| NMR Offset |
15.5012 |
| NMR Spectrometer Frequency |
300.135 |
| Observed nucleus |
1H |
| Origin |
1H_SBI_36227_27302 |
| Owner |
Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc. |
| Sample State |
soluted |
| Solvent |
DMSO-d6 |
| Source File Reference |
VendorID: D76065; Labnumber: SC_0037-0146; SBI_ID: SBI-027306 |
| Temperature |
315 °C |
![(3aR,6aS)-5-(1,3-benzodioxol-5-yl)-3-(2-chlorophenyl)-3aH-pyrrolo[3,4-d]isoxazole-4,6(5H,6aH)-dione](/api/spectrum/80TNSem4wmt/structure.png?h=300&w=458 "(3aR,6aS)-5-(1,3-benzodioxol-5-yl)-3-(2-chlorophenyl)-3aH-pyrrolo[3,4-d]isoxazole-4,6(5H,6aH)-dione")
