| SpectraBase Spectrum ID |
DY9Jyhb2Xpk |
| Name |
3-Butylphthalide |
| CAS Registry Number |
6066-49-5 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C12H14O2 |
| GC Column |
J&W DB-5 (30 m x 0.25 mm ID x 0.25 ??m film thickness) |
| GC Oven Program |
60 ??C to 246 ??C at 3 ??C/min. |
| InChI |
InChI=1S/C12H14O2/c1-2-3-8-11-9-6-4-5-7-10(9)12(13)14-11/h4-7,11H,2-3,8H2,1H3 |
| InChIKey |
HJXMNVQARNZTEE-UHFFFAOYSA-N |
| Molecular Weight |
190.242 g/mol |
| SMILES |
C1(OC(CCCC)c2c1cccc2)=O |
| SPLASH |
splash10-001i-5900000000-c2956c0c95c657db570c |
| Source |
ex LOMATIUM DISSECTIUM ex VASU DEV |
| Source of Spectrum |
Adams' Essential Oil Components (GC-MS), Version 4 |
| Synonyms |
Butyl phthalide<3-> |
| Wiley ID |
1885969 |
