| SpectraBase Spectrum ID |
1OJLP9dfMEq |
| Name |
Cyclopropanecarboxamide, N-[2,3-dihydro-7-(2-methyl-1-oxopropyl)-1,4-benzodioxin-6-yl]- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
289.131408092 u |
| Formula |
C16H19NO4 |
| InChI |
InChI=1S/C16H19NO4/c1-9(2)15(18)11-7-13-14(21-6-5-20-13)8-12(11)17-16(19)10-3-4-10/h7-10H,3-6H2,1-2H3,(H,17,19) |
| InChIKey |
VALHEXZPZHMYAO-UHFFFAOYSA-N |
| SMILES |
C1(=C(NC(C2CC2)=O)C=C2C(=C1)OCCO2)C(=O)C(C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.897081 |
![Cyclopropanecarboxamide, N-[2,3-dihydro-7-(2-methyl-1-oxopropyl)-1,4-benzodioxin-6-yl]-](/api/spectrum/1OJLP9dfMEq/structure.png?h=300&w=458 "Cyclopropanecarboxamide, N-[2,3-dihydro-7-(2-methyl-1-oxopropyl)-1,4-benzodioxin-6-yl]-")
