| SpectraBase Spectrum ID |
5a1692FTPC7 |
| Name |
7-(3'-Methylbutyl)benzo[b]-(1,4)-dioxepin-3-one |
| Alternate Name(s) |
7-isopentyl-2H-1,5-benzodioxepin-3(4H)-one
7-isopentyl-1,5-benzodioxepin-3-one
7-(3-Methylbutyl)-1,5-benzodioxepin-3-one |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C14H18O3 |
| InChI |
InChI=1S/C14H18O3/c1-10(2)3-4-11-5-6-13-14(7-11)17-9-12(15)8-16-13/h5-7,10H,3-4,8-9H2,1-2H3 |
| InChIKey |
AWAHFLZWCBUHMX-UHFFFAOYSA-N |
| Molecular Weight |
234.295 g/mol |
| SMILES |
c12OCC(COc2ccc(c1)CCC(C)C)=O |
| SPLASH |
splash10-004i-1930000000-06cad8595650c2d0b6ef |
| Source of Spectrum |
K1-2003-3740-16 |
| Wiley ID |
1521537 |
![7-(3'-Methylbutyl)benzo[b]-(1,4)-dioxepin-3-one](/api/spectrum/5a1692FTPC7/structure.png?h=300&w=458 "7-(3'-Methylbutyl)benzo[b]-(1,4)-dioxepin-3-one")
