SpectraBase Spectrum ID |
JoSzrpJRbjZ |
Name |
|
Copyright |
Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
Formula |
C22H22NO5Br |
InChI |
InChI=1S/C22H22BrNO5/c23-17-9-20-19(26-13-27-20)8-15(17)16-10-22(28-6-7-29-22)11-18(25)21(16)24-12-14-4-2-1-3-5-14/h1-5,8-9,12,16,18,21,25H,6-7,10-11,13H2/b24-12+ |
InChIKey |
HVPJDLBNKNMQCX-WYMPLXKRSA-N |
Molecular Weight |
459.0675 |
SMILES |
OC1C(\N=C\c2ccccc2)C(CC2(OCCO2)C1)c1c(Br)cc2c(c1)OCO2 |
SPLASH |
splash10-001i-5659000000-f1aab2aa235140fa60e2 |
Source of Spectrum |
Chemical Concepts, A Wiley Division, Weinheim, Germany |