SpectraBase Spectrum ID |
IPCyXYH7EQi |
Name |
1-[2'-(3''-Chloro-.alpha.-deuteriobenzyl)-4',5'-dimethoxyphenyl]-propan-2-ol |
Comments |
Less than 3 mono-isotopic peaks |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C18H20DClO3 |
InChI |
InChI=1S/C18H21ClO3/c1-12(20)7-14-10-17(21-2)18(22-3)11-15(14)8-13-5-4-6-16(19)9-13/h4-6,9-12,20H,7-8H2,1-3H3/i8D |
InChIKey |
JSDARIUSVOBOQT-BNEYPBHNSA-N |
Molecular Weight |
321.822 g/mol |
SMILES |
OC(Cc1c(cc(c(OC)c1)OC)C(c1cc(Cl)ccc1)[2D])C |
SPLASH |
splash10-00di-0009000000-62489986e18fdf0f3039 |
Source of Spectrum |
F2-127-6-5 |
Wiley ID |
1549883 |