| SpectraBase Spectrum ID |
4SKo5Xf9kG |
| Name |
ethyl (2S,3R)-2,3-dimethylnon-4-ynoate |
| Appearance |
Colorless oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
210.161979946 u |
| Formula |
C13H22O2 |
| InChI |
InChI=1S/C13H22O2/c1-5-7-8-9-10-11(3)12(4)13(14)15-6-2/h11-12H,5-8H2,1-4H3/t11-,12-/m0/s1 |
| InChIKey |
WWFDDLDVYJXNPU-RYUDHWBXSA-N |
| Instrument Name |
Finnigan MAT 95Q or Finnigan MAT 90 or JEOL JMS-700 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/chem.201601911 |
| Molecular Weight |
210.317 g/mol |
| Quality |
338 |
| Reported Formula |
C13H22O2 |
| SMILES |
C([C@@]([C@@](C(OCC)=O)(C)[H])(C)[H])#CCCCC |
| SPLASH |
splash10-00kb-3900000000-8b8a460c696171a7b424 |
| Sample Comments |
dr = 97:3 |
| Source of Spectrum |
QE-22-SM36-anti-1c (DOI: 10.1002/chem.201601911) |
| Wiley ID |
1903498 |
