| SpectraBase Spectrum ID |
LJMKhzyfzE |
| Name |
Methyl (1S,2R)-2-(but-2-en-2-yl)cyclohex-3-enecarboxylate |
| Appearance |
Colorless liquid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C12H18O2 |
| InChI |
InChI=1S/C12H18O2/c1-4-9(2)10-7-5-6-8-11(10)12(13)14-3/h4-5,7,10-11H,6,8H2,1-3H3/t10-,11-/m0/s1 |
| InChIKey |
NQYMICFZCNCZKI-QWRGUYRKSA-N |
| Instrument Name |
Agilent 6890N-5975 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.3762/bjoc.8.72 |
| Molecular Weight |
194.274 g/mol |
| Reported Formula |
C12H18O2 |
| SMILES |
C1C[C@@]([C@@](C=C1)(C(=CC)C)[H])(C(=O)OC)[H] |
| SPLASH |
splash10-0a4l-5900000000-60dd0ea1a39f4f34698e |
| Sample Comments |
E/Z = 55:45 |
| Source of Spectrum |
BJO-8-SM9-5e |
| Wiley ID |
1867417 |
