| SpectraBase Spectrum ID |
5C6SOEKTH0D |
| Name |
4-Butyl-1-benzopyran-2-one |
| Alternate Name(s) |
4-butylchromen-2-one
4-Butylcoumarin |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C13H14O2 |
| InChI |
InChI=1S/C13H14O2/c1-2-3-6-10-9-13(14)15-12-8-5-4-7-11(10)12/h4-5,7-9H,2-3,6H2,1H3 |
| InChIKey |
QWNXVTKFJMFHDH-UHFFFAOYSA-N |
| Molecular Weight |
202.253 g/mol |
| SMILES |
C1(=CC(=O)Oc2c1cccc2)CCCC |
| SPLASH |
splash10-03di-0920000000-b8071cc44f8272484b79 |
| Source of Spectrum |
KC-1991-209-20 |
| Wiley ID |
1200084 |
