SpectraBase Spectrum ID |
7kgAGztnNoe |
Name |
(.alpha.'S,2R)-2-(5'-Benzyloxy-3'-bromo-2'-methoxy-.alpha.'-methylbenzyloxy)propan-al |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
392.062322152 u |
Formula |
C19H21BrO4 |
InChI |
InChI=1S/C19H21BrO4/c1-13(11-21)24-14(2)17-9-16(10-18(20)19(17)22-3)23-12-15-7-5-4-6-8-15/h4-11,13-14H,12H2,1-3H3/t13-,14+/m1/s1 |
InChIKey |
BCJGUXAAVAJZRT-KGLIPLIRSA-N |
Instrument Name |
Hewlett Packard 5986 |
Ionization Type |
EI |
Literature Reference DOI |
10.3998/ark.5550190.0003.911 |
Molecular Weight |
393.277 g/mol |
Optical Rotation |
[a]D = -52.0 (c = 1.0, CHCl3) |
Quality |
94 |
SMILES |
C1(=C(C(=CC(=C1)OCC1=CC=CC=C1)[C@](C)(O[C@@](C=O)(C)[H])[H])OC)Br |
SPLASH |
splash10-0006-9002000000-cd92248d0382cf2f1da1 |
Source of Spectrum |
ARK-2002-113-30 (DOI: 10.3998/ark.5550190.0003.911) |
Wiley ID |
1904843 |