For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
Benzenepropanoic acid, .beta.-[[(4-bromophenyl)imino]methyl]-.beta.-hydroxy-.alpha.,.alpha.-dimethoxy-, methyl ester, (.+-.)-
SpectraBase Compound ID H3lNyZZE96F
InChI InChI=1S/C19H20BrNO5/c1-24-17(22)19(25-2,26-3)18(23,14-7-5-4-6-8-14)13-21-16-11-9-15(20)10-12-16/h4-13,23H,1-3H3/b21-13+
InChIKey IIYZOWNBIVPMTC-FYJGNVAPSA-N
Mol Weight 422.28 g/mol
Molecular Formula C19H20BrNO5
Exact Mass 421.052486 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 95K95TbwGBn
Name Benzenepropanoic acid, .beta.-[[(4-bromophenyl)imino]methyl]-.beta.-hydroxy-.alpha.,.alpha.-dimethoxy-, methyl ester, (.+-.)-
CAS Registry Number 131856-87-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H20BrNO5
InChI InChI=1S/C19H20BrNO5/c1-24-17(22)19(25-2,26-3)18(23,14-7-5-4-6-8-14)13-21-16-11-9-15(20)10-12-16/h4-13,23H,1-3H3/b21-13+
InChIKey IIYZOWNBIVPMTC-FYJGNVAPSA-N
Molecular Weight 422.275 g/mol
SMILES OC(C(C(=O)OC)(OC)OC)(\C=N\c1ccc(cc1)Br)c1ccccc1
SPLASH splash10-001i-1900000000-814d871aeb37f4cb585d
Source of Spectrum F-46-6811-5
Synonyms Methyl (4E)-4-[(4-bromophenyl)imino]-3-hydroxy-2,2-dimethoxy-3-phenylbutanoate Methyl 4-(p-bromophenyl)imino-3-hydroxy-2,2-dimethoxy-3-phenylbutanoate
Wiley ID 1378259