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

*Links on SpectraBase are not permalinks.
2-(4-benzoxybenzyl)malonic acid
SpectraBase Compound ID CTYZfOCL5P6
InChI InChI=1S/C17H16O5/c18-16(19)15(17(20)21)10-12-6-8-14(9-7-12)22-11-13-4-2-1-3-5-13/h1-9,15H,10-11H2,(H,18,19)(H,20,21)
InChIKey UJTZCJBGIQSKLY-UHFFFAOYSA-N
Mol Weight 300.31 g/mol
Molecular Formula C17H16O5
Exact Mass 300.099774 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 81sAoOLA37D
Name 2-(4-benzoxybenzyl)malonic acid
CAS Registry Number 73271-40-6
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H16O5
InChI InChI=1S/C17H16O5/c18-16(19)15(17(20)21)10-12-6-8-14(9-7-12)22-11-13-4-2-1-3-5-13/h1-9,15H,10-11H2,(H,18,19)(H,20,21)
InChIKey UJTZCJBGIQSKLY-UHFFFAOYSA-N
Molecular Weight 300.310 g/mol
SMILES OC(C(C(=O)O)Cc1ccc(OCc2ccccc2)cc1)=O
SPLASH splash10-0006-9000000000-1ffb1fa6552cd0c79a0d
Source of Spectrum KC-1982-2054-0
Synonyms 2-[(4-benzyloxyphenyl)methyl]propanedioic acid 2-[(4-phenylmethoxyphenyl)methyl]propanedioic acid
Wiley ID 1302883