| SpectraBase Spectrum ID |
8JDPmt52etk |
| Name |
Santolina triene |
| CAS Registry Number |
2153-66-4 |
| Classification |
Fragrance, flavor |
| Comments |
Spectrum verified by crosschecking against external libraries (one reference spectrum with similarity >= 99% found); Spectrum verified by independent measurements in external laboratories |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
136.125200515 u |
| Formula |
C10H16 |
| InChI |
InChI=1S/C10H16/c1-6-10(9(4)5)7-8(2)3/h6-7,10H,1,4H2,2-3,5H3 |
| InChIKey |
ZQGDEJAPCUGBRH-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
136.238 g/mol |
| Nominal Mass |
136 u |
| Quality |
870 |
| Retention Index |
948 |
| SMILES |
C(C(=C)C)(C=C(C)C)C=C |
| SPLASH |
splash10-0006-9200000000-4bab689904406e1e4671 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
CID519872
3-Ethenyl-2,5-dimethylhexa-1,4-diene
2,5-Dimethyl-3-vinyl-1,4-hexadiene |
| Technique |
GC/MS |
| Wiley ID |
DD2024_009155 |
