| SpectraBase Spectrum ID |
8v7iOSsruBF |
| Name |
1-(3,5-dihydroxyphenyl)-2-heptanone |
| CAS Registry Number |
15601-09-9 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C13H18O3 |
| InChI |
InChI=1S/C13H18O3/c1-2-3-4-5-11(14)6-10-7-12(15)9-13(16)8-10/h7-9,15-16H,2-6H2,1H3 |
| InChIKey |
UYOAKZGQLBHUHR-UHFFFAOYSA-N |
| Molecular Weight |
222.284 g/mol |
| SMILES |
Oc1cc(cc(c1)CC(=O)CCCCC)O |
| SPLASH |
splash10-00di-9000000000-df0deaaa7c46fd77b99f |
| Source of Spectrum |
JA-50-479-0 |
| Synonyms |
1-[3,5-bis(oxidanyl)phenyl]heptan-2-one |
| Wiley ID |
1222654 |
