| SpectraBase Spectrum ID |
AYIB25ZZZ5B |
| Name |
Isobornyl acetate |
| CAS Registry Number |
125-12-2 |
| Classification |
Flavor, fragrance |
| Copyright |
Copyright © 2024-2025 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
196.146329882 u |
| Formula |
C12H20O2 |
| InChI |
InChI=1S/C12H20O2/c1-8(13)14-10-7-9-5-6-12(10,4)11(9,2)3/h9-10H,5-7H2,1-4H3/t9-,10-,12+/m0/s1 |
| InChIKey |
KGEKLUUHTZCSIP-OJBNZGHXSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
196.290 g/mol |
| Nominal Mass |
196 u |
| Quality |
999 |
| Retention Index |
1449 |
| SMILES |
[C@]12(C([C@](C[C@@]2(OC(=O)C)[H])(CC1)[H])(C)C)C |
| SPLASH |
splash10-0077-9500000000-047bc33f1cfb57d1370d |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
Borneol,acetate
Bornyl acetate
[(6S)-1,7,7-Trimethyl-6-bicyclo[2.2.1]heptanyl] acetate |
| Technique |
GC/MS |
| Wiley ID |
DD2024_010632 |
