| SpectraBase Spectrum ID |
1X4JdFiVR6E |
| Name |
4,7-heptanoisobenzofuran-1(3H)-on |
| CAS Registry Number |
102652-18-6 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C15H18O2 |
| InChI |
InChI=1S/C15H18O2/c16-15-14-12-7-5-3-1-2-4-6-11(8-9-12)13(14)10-17-15/h8-9H,1-7,10H2 |
| InChIKey |
ZQZCYCYXTOSMIP-UHFFFAOYSA-N |
| Molecular Weight |
230.307 g/mol |
| SMILES |
c12C(OCc2c2CCCCCCCc1cc2)=O |
| SPLASH |
splash10-03di-0920000000-f16ac24e411fd78892ed |
| Source of Spectrum |
K-119-2713-5 |
| Synonyms |
12-oxatricyclo[7.5.2.0(10,14)]hexadeca-1(14),9,15-trien-11-one
3,6-Heptanophthalid |
| Wiley ID |
1232205 |
