| SpectraBase Spectrum ID |
KdvUThI1kUQ |
| Name |
(3-13C,1-2H)Geranylgeranial |
| Appearance |
Colourless oil |
| Comments |
Original formula: C19[13C]H31DO |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C20H32O |
| InChI |
InChI=1S/C20H32O/c1-17(2)9-6-10-18(3)11-7-12-19(4)13-8-14-20(5)15-16-21/h9,11,13,15-16H,6-8,10,12,14H2,1-5H3/b18-11+,19-13+,20-15+/i16D,20+1 |
| InChIKey |
AVHRJMXIKKJVHG-VEYMUETQSA-N |
| Instrument Name |
Agilent 7890B-5977A |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/anie.201812216 |
| Molecular Weight |
290.473 g/mol |
| SMILES |
C(\[13C](C)=C\C([D])=O)C\C=C\(CC\C=C\(CCC=C(C)C)C)C |
| SPLASH |
splash10-014l-9300000000-01ec413b12fcf0b398b4 |
| Source of Spectrum |
ACI-58-SM54-S7 |
| Thin-Layer Chromatography |
Rf = 0.61 (cyclohexane/EtOAc, 3:1) |
| Wiley ID |
1840427 |
