| SpectraBase Spectrum ID |
5YdXqkeTswM |
| Name |
Myrac aldehyde |
| CAS Registry Number |
37677-14-8 |
| 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 |
192.151415263 u |
| Formula |
C13H20O |
| InChI |
InChI=1S/C13H20O/c1-11(2)4-3-5-12-6-8-13(10-14)9-7-12/h4,6,10,13H,3,5,7-9H2,1-2H3 |
| InChIKey |
MQBIZQLCHSZBOI-UHFFFAOYSA-N |
| Molecular Weight |
192.302 g/mol |
| Number of Peaks |
50 |
| RI1 |
1522 |
| RI2 |
1198 |
| RI3 |
1373 |
| RI4 |
1335 |
| SMILES |
C1C(CCC(=C1)CCC=C(C)C)C=O |
| SPLASH |
splash10-014l-9200000000-4254170191e01fe69864 |
| 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 |
3-Cyclohexene-1-carboxaldehyde, 4-(4-methyl-3-pentenyl)- |
| Wiley ID |
LM_FFNSC3_1294 |
