| SpectraBase Spectrum ID |
B4yWFvDzVYD |
| Name |
Isoeugenol |
| CAS Registry Number |
6380-24-1 |
| 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 |
178.099379689 u |
| Formula |
C11H14O2 |
| InChI |
InChI=1S/C11H14O2/c1-4-5-9-6-7-10(12-2)11(8-9)13-3/h4-8H,1-3H3/b5-4- |
| InChIKey |
NNWHUJCUHAELCL-PLNGDYQASA-N |
| Molecular Weight |
178.231 g/mol |
| Number of Peaks |
50 |
| RI1 |
1455 |
| RI2 |
1133 |
| SMILES |
c1(ccc(cc1OC)\C=C/C)OC |
| SPLASH |
splash10-004i-4900000000-8d9258911e200ed53d25 |
| 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 |
Benzene, 1,2-dimethoxy-4-(1Z)-1-propenyl- |
| Wiley ID |
LM_FFNSC3_1465 |
