| SpectraBase Spectrum ID |
JpovOPE9MrP |
| Name |
Ethyl (E)-(1-(13)C)-6,7-dihydrogeranate |
| Appearance |
Colorless oil |
| Carrier Gas |
Helium |
| Comments |
Original formula: C11[13C]H22O2 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C12H22O2 |
| InChI |
InChI=1S/C12H22O2/c1-5-14-12(13)9-11(4)8-6-7-10(2)3/h9-10H,5-8H2,1-4H3/b11-9+/i12+1 |
| InChIKey |
ZUEFKHXRQLTKCX-DWQIZZDSSA-N |
| Instrument Name |
Agilent 7890B-5977A |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/anie.202014180 |
| Molecular Weight |
199.298 g/mol |
| Reported Formula |
C11(13)C1H22O2 |
| SMILES |
C(CC\C(=C\[13C](OCC)=O)C)C(C)C |
| SPLASH |
splash10-0f6x-9500000000-eecca5be16861ad38971 |
| Source of Spectrum |
ACI-60-SM51-S2b |
| Thin-Layer Chromatography |
Rf = 0.20 (cyclohexane/EtOAc, 50:1) |
| Wiley ID |
1880486 |
