SpectraBase Spectrum ID |
HcaYKE560H |
Name |
methyl (4R,6S)-2,4-dimethyl-6-phenyl-hept-2-enoate |
Appearance |
Colorless oil |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C16H22O2 |
InChI |
InChI=1S/C16H22O2/c1-12(11-14(3)16(17)18-4)10-13(2)15-8-6-5-7-9-15/h5-9,11-13H,10H2,1-4H3/t12-,13+/m1/s1 |
InChIKey |
ZTIIWQYGGWJZFR-OLZOCXBDSA-N |
Instrument Name |
FINNIGAN MAT 95Q |
Ionization Type |
EI |
Literature Reference DOI |
10.1002/chem.202002297 |
Molecular Weight |
246.350 g/mol |
Reported Formula |
C16H22O2 |
SMILES |
c1([C@@](C)(C[C@](C=C(C)C(OC)=O)(C)[H])[H])ccccc1 |
SPLASH |
splash10-0006-0900000000-a027fb0e5ef3dc55e055 |
Sample Comments |
dr = >80:20 |
Source of Spectrum |
QE-76-SM21-syn-3f |
Wiley ID |
1843561 |