SpectraBase Spectrum ID |
uuHtMOk6wQ |
Name |
Isoledene |
CAS Registry Number |
95910-36-4 |
Classification |
Flavor |
Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
204.187800773 u |
Formula |
C15H24 |
InChI |
InChI=1S/C15H24/c1-9-6-8-12-14(15(12,3)4)13-10(2)5-7-11(9)13/h9-10,12,14H,5-8H2,1-4H3/t9-,10?,12-,14-/m1/s1 |
InChIKey |
NUQDPKOFUKFKFD-WEKSXKLRSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
204.357 g/mol |
Nominal Mass |
204 u |
Quality |
896 |
Retention Index |
1561 |
SMILES |
[C@]12([C@](C2(C)C)(CC[C@](C2=C1C(CC2)C)(C)[H])[H])[H] |
SPLASH |
splash10-0btc-4900000000-3fa6a0db3463778ab3aa |
Source of Spectrum |
DigiLab GmbH (C) 2024 |
Synonyms |
1,1,4,7-Tetramethyl-1a,2,3,4,5,6,7,7b-octahydro-1H-cyclopropa[e]azulene |
Technique |
GC/MS |
Wiley ID |
DD2024_017095 |