| SpectraBase Spectrum ID |
JHUv7zpiLse |
| Name |
Verbenone |
| CAS Registry Number |
1196-01-6 |
| Classification |
Pheromone, pine trees bio pesticide |
| Comments |
Spectrum verified by crosschecking against external libraries (one reference spectrum with similarity >= 99% found) |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
150.104465070 u |
| Formula |
C10H14O |
| InChI |
InChI=1S/C10H14O/c1-6-4-9(11)8-5-7(6)10(8,2)3/h4,7-8H,5H2,1-3H3/t7-,8+/m1/s1 |
| InChIKey |
DCSCXTJOXBUFGB-SFYZADRCSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
150.221 g/mol |
| Nominal Mass |
150 u |
| Quality |
938 |
| Retention Index |
1128 |
| SMILES |
[C@@]12(C([C@@](C2)(C(C=C1C)=O)[H])(C)C)[H] |
| SPLASH |
splash10-0a73-9500000000-fccf6c19e87a4bc62fe5 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
4,6,6-Trimethyl-bicyclo-(3.1.1)hept-3-en-2-one |
| Technique |
GC/MS |
| Wiley ID |
DD2024_007511 |
