| SpectraBase Spectrum ID |
5NzTsOtYA86 |
| Name |
Tagetone |
| CAS Registry Number |
3588-18-9 |
| 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 |
152.120115134 u |
| Formula |
C10H16O |
| InChI |
InChI=1S/C10H16O/c1-5-9(4)7-10(11)6-8(2)3/h5,7-8H,1,6H2,2-4H3/b9-7- |
| InChIKey |
RJXKHBTYHGBOKV-CLFYSBASSA-N |
| Molecular Weight |
152.237 g/mol |
| Number of Peaks |
50 |
| RI1 |
1152 |
| RI2 |
829 |
| SMILES |
C(C(\C=C/(C=C)C)=O)C(C)C |
| SPLASH |
splash10-00kb-9200000000-2bcdec3c7c931caf909e |
| 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 |
5,7-Octadien-4-one, 2,6-dimethyl-, (5Z)- |
| Wiley ID |
LM_FFNSC3_1585 |
