| SpectraBase Spectrum ID |
2PrYcIAjWNw |
| Name |
Butylidene phthalide <(3Z)-> |
| Source of Sample |
SAFC Cat.no. W333301 |
| CAS Registry Number |
72917-31-8 |
| Copyright |
Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved. |
| Exact Mass |
188.083729624 u |
| Formula |
C12H12O2 |
| InChI |
InChI=1S/C12H12O2/c1-2-3-8-11-9-6-4-5-7-10(9)12(13)14-11/h4-8H,2-3H2,1H3/b11-8- |
| InChIKey |
WMBOCUXXNSOQHM-FLIBITNWSA-N |
| Molecular Weight |
188.226 g/mol |
| Number of Peaks |
50 |
| RI1 |
1673 |
| RI2 |
1350 |
| RI3 |
1876 |
| RI4 |
1839 |
| SMILES |
C1(=O)O\C(c2ccccc12)=C\CCC |
| SPLASH |
splash10-0pdi-3900000000-c59caf34b6e63f9f0bca |
| Sample Comments |
RI1: measured on SLB-5ms (Hydro)
RI2: measured on SLB-5ms (FAMEs)
RI3: measured on Supelcowax-10 (FAMEs)
RI4: measured on Supelcowax-10 (FAEEs)
RI5: measured on Equity-1 (Hydro) |
| Source of Spectrum |
Prof. L. Mondello (Chromaleont s.r.l./Univ. Messina, Italy) |
| Synonyms |
1(3H)-Isobenzofuranone, 3-butylidene-, (3Z)- |
| Wiley ID |
LM_FFNSC3_310 |
