SpectraBase Spectrum ID |
Hlyfm4iUp2n |
Name |
p-Phenylphenacyl[3,3'-bis(13C),3,3,3,3',3',3'-hexadeuterio]isobutyrate |
Comments |
Original formula: C16[13C]2H12D6O3 |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C18H18O3 |
InChI |
InChI=1S/C18H18O3/c1-13(2)18(20)21-12-17(19)16-10-8-15(9-11-16)14-6-4-3-5-7-14/h3-11,13H,12H2,1-2H3/i1+1D3,2+1D3 |
InChIKey |
RSVQLPPONUWMGZ-KLFIIISESA-N |
Molecular Weight |
290.360 g/mol |
SMILES |
C([13C]([D])([D])[D])([13C]([D])([D])[D])C(OCC(c1ccc(cc1)-c1ccccc1)=O)=O |
SPLASH |
splash10-001i-0900000000-7359226d1e97b757f915 |
Source of Spectrum |
KC-1988-3204-0 |
Synonyms |
Propanoic-3-¹³C-3,3,3-D3 acid, 2-(methyl-¹³C-D3)-, 2-[1,1'-biphenyl]-4-yl-2-oxoethyl ester
p-Phenylphenacyl[3,3'-bis(¹³C),3,3,3,3',3',3'-hexadeuterio]isobutyrate |
Wiley ID |
1286277 |