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

*Links on SpectraBase are not permalinks.
3-(4-bromophenyl)-2,3-dihydroxy-2-phenyl-propionic acid methyl ester
SpectraBase Compound ID DJMVDerSCxX
InChI InChI=1S/C16H15BrO4/c1-21-15(19)16(20,12-5-3-2-4-6-12)14(18)11-7-9-13(17)10-8-11/h2-10,14,18,20H,1H3
InChIKey XCAYZSQYFDVSDX-UHFFFAOYSA-N
Mol Weight 351.2 g/mol
Molecular Formula C16H15BrO4
Exact Mass 350.015372 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 83AgeITh6qv
Name 3-(4-bromophenyl)-2,3-dihydroxy-2-phenyl-propionic acid methyl ester
Alternate Name(s) 3-(4-bromophenyl)-2,3-dihydroxy-2-phenylpropanoic acid methyl ester methyl 3-(4-bromophenyl)-2,3-bis(oxidanyl)-2-phenyl-propanoate methyl 3-(4-bromophenyl)-2,3-dihydroxy-2-phenyl-propanoate
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H15BrO4
InChI InChI=1S/C16H15BrO4/c1-21-15(19)16(20,12-5-3-2-4-6-12)14(18)11-7-9-13(17)10-8-11/h2-10,14,18,20H,1H3
InChIKey XCAYZSQYFDVSDX-UHFFFAOYSA-N
Molecular Weight 351.196 g/mol
SMILES OC(C(C(=O)OC)(c1ccccc1)O)c1ccc(cc1)Br
SPLASH splash10-014i-9000000000-72aa9b146386bd44b395
Source of Spectrum F-51-13397-4
Wiley ID 794468