| SpectraBase Spectrum ID |
6H9CGUInusS |
| Name |
2-(4-{16,18-dioxo-17-azapentacyclo[6.6.5.0²,⁷.0⁹,¹⁴.0¹⁵,¹⁹]nonadeca-2(7),3,5,9(14),10,12-hexaen-17-yl}phenoxy)acetic acid |
| Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
425.126322711 u |
| Formula |
C26H19NO5 |
| InChI |
InChI=1S/C26H19NO5/c28-20(29)13-32-15-11-9-14(10-12-15)27-25(30)23-21-16-5-1-2-6-17(16)22(24(23)26(27)31)19-8-4-3-7-18(19)21/h1-12,21-24H,13H2,(H,28,29)/t21-,22+,23-,24-/m0/s1 |
| InChIKey |
HFCNLQNFSHEDCK-KIHHCIJBSA-N |
| Molecular Weight |
425.440 g/mol |
| NMR Offset |
18.0059 |
| NMR Spectrometer Frequency |
300.135 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2017_2815 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/9236454; Lab Info: KWN; Lab Number: KWN-0003153 |
| Temperature |
29.85 °C |
![2-(4-{16,18-dioxo-17-azapentacyclo[6.6.5.0²,⁷.0⁹,¹⁴.0¹⁵,¹⁹]nonadeca-2(7),3,5,9(14),10,12-hexaen-17-yl}phenoxy)acetic acid](/api/spectrum/6H9CGUInusS/structure.png?h=300&w=458 "2-(4-{16,18-dioxo-17-azapentacyclo[6.6.5.0²,⁷.0⁹,¹⁴.0¹⁵,¹⁹]nonadeca-2(7),3,5,9(14),10,12-hexaen-17-yl}phenoxy)acetic acid")
