| SpectraBase Spectrum ID |
3vmDy800cu3 |
| Name |
tert-Butyl (S,Z)-7-hydroxyoct-2-en-4-ynoate |
| Appearance |
Yellow oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
210.125594437 u |
| Formula |
C12H18O3 |
| InChI |
InChI=1S/C12H18O3/c1-10(13)8-6-5-7-9-11(14)15-12(2,3)4/h7,9-10,13H,8H2,1-4H3/b9-7-/t10-/m0/s1 |
| InChIKey |
IKURFAZMHBCAKQ-RNKPRXRFSA-N |
| Instrument Name |
Finnigan MAT 8200 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/anie.201602125 |
| Molecular Weight |
210.273 g/mol |
| Optical Rotation |
[a]D20 = +49.2 (c = 1.0, CHCl3) |
| Quality |
229 |
| Reported Formula |
C12H18O3 |
| SMILES |
O[C@](CC#C\C=C/C(OC(C)(C)C)=O)(C)[H] |
| SPLASH |
splash10-08gi-9400000000-7d300585aa10814a9db3 |
| Source of Spectrum |
ACI-55-SM4-13 (DOI: 10.1002/anie.201602125) |
| Wiley ID |
1897455 |
