| SpectraBase Spectrum ID |
LwFnvn29LEC |
| Name |
1-(2-hydroxy-3,6-dimethyl-phenyl)propan-1-one |
| Alternate Name(s) |
1-(2-hydroxy-3,6-dimethylphenyl)-1-propanone
1-(3,6-dimethyl-2-oxidanyl-phenyl)propan-1-one |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C11H14O2 |
| InChI |
InChI=1S/C11H14O2/c1-4-9(12)10-7(2)5-6-8(3)11(10)13/h5-6,13H,4H2,1-3H3 |
| InChIKey |
ISFGCMAPRWJFAK-UHFFFAOYSA-N |
| Molecular Weight |
178.231 g/mol |
| SMILES |
Oc1c(C(CC)=O)c(ccc1C)C |
| SPLASH |
splash10-0002-0900000000-f6ff7fa5104e1ff49f99 |
| Source of Spectrum |
SO-0-27-10 |
| Wiley ID |
1540408 |
