| SpectraBase Spectrum ID |
KGO9FuMAmBL |
| Name |
Pygmaein |
| CAS Registry Number |
16749-07-8 |
| 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 |
194.094294308 u |
| Formula |
C11H14O3 |
| InChI |
InChI=1S/C11H14O3/c1-7(2)8-5-4-6-9(12)10(13)11(8)14-3/h4-7H,1-3H3,(H,12,13) |
| InChIKey |
WKNNCBGPLIVJTL-UHFFFAOYSA-N |
| Molecular Weight |
194.230 g/mol |
| Number of Peaks |
50 |
| RI1 |
1586 |
| SMILES |
OC1=CC=CC(=C(C1=O)OC)C(C)C |
| SPLASH |
splash10-002f-6900000000-5c129029d0e01cf46635 |
| 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 |
2,4,6-Cycloheptatrien-1-one, 2-hydroxy-3-methoxy-4-(1-methylethyl)- |
| Wiley ID |
LM_FFNSC3_2304 |
