| SpectraBase Spectrum ID |
5VGKH2769RI |
| Name |
(Z)-2-(Hexa-2,4-diyn-1-ylidene)-1,6-dioxaspiro[4.4]non-3-ene |
| CAS Registry Number |
4575-53-5 |
| Classification |
Essential oil |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
200.083729624 u |
| Formula |
C13H12O2 |
| InChI |
InChI=1S/C13H12O2/c1-2-3-4-5-7-12-8-10-13(15-12)9-6-11-14-13/h7-8,10H,6,9,11H2,1H3/b12-7+ |
| InChIKey |
WTRXKCNFPMTAJV-KPKJPENVSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
200.237 g/mol |
| Nominal Mass |
200 u |
| Quality |
922 |
| Retention Index |
1425 |
| SMILES |
C12(O\C(C=C2)=C/C#CC#CC)OCCC1 |
| SPLASH |
splash10-0ufr-4910000000-081e4b61e8a81241ea36 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
(2E)-2-(Hexa-2,4-diyn-1-ylidene)-1,6-dioxaspiro[4.4]non-3-ene |
| Technique |
GC/MS |
| Wiley ID |
DD2024_030556 |
