| SpectraBase Spectrum ID |
B1N5yU9ZExX |
| Name |
16-(Morpholinomethyl)-5,6,8,9,11,12-hexahydro-2H-(1,4,7,10,13)pentaoxacyclopentadeca (2,3-H) chromen-18(3H)-one |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
435.189316890 u |
| Formula |
C22H29NO8 |
| InChI |
InChI=1S/C22H29NO8/c24-20-15-17(16-23-3-5-25-6-4-23)18-1-2-19-22(21(18)31-20)30-14-12-28-10-8-26-7-9-27-11-13-29-19/h1-2,15H,3-14,16H2 |
| InChIKey |
VXXZFKCRULPNEP-UHFFFAOYSA-N |
| Molecular Weight |
435.473 g/mol |
| SMILES |
C12=C(C(CN3CCOCC3)=CC(O1)=O)C=CC1=C2OCCOCCOCCOCCO1 |
