| SpectraBase Spectrum ID |
GqmQdVGU6OL |
| Name |
(2S,4R)-4-t-Butyl-2-(3'-propenyl)-cyclohexanone-2-carboxaldehyde |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
222.161979946 u |
| Formula |
C14H22O2 |
| InChI |
InChI=1S/C14H22O2/c1-5-8-14(10-15)9-11(13(2,3)4)6-7-12(14)16/h5,10-11H,1,6-9H2,2-4H3/t11-,14+/m1/s1 |
| InChIKey |
XXILERHCGGVIDG-RISCZKNCSA-N |
| Instrument Name |
Finigan GCQ |
| Ionization Type |
EI |
| Literature Reference DOI |
10.3998/ark.5550190.0002.117 |
| Molecular Weight |
222.328 g/mol |
| Quality |
83 |
| Reported Formula |
C14H22O2 |
| SMILES |
[C@]1(C(CC[C@](C1)(C(C)(C)C)[H])=O)(C=O)CC=C |
| SPLASH |
splash10-02t9-8900000000-84a48b1c403b302c2798 |
| Sample Comments |
Major isomer |
| Source of Spectrum |
ARK-2001-274-9 (DOI: 10.3998/ark.5550190.0002.117) |
| Wiley ID |
1908665 |
