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

*Links on SpectraBase are not permalinks.
Ethyl 3-(3-chloropropyl)-2-hydroxy-5-(2-hydroxy-5-chloro-3-methylbenzoyl)benzoate
SpectraBase Compound ID 8HcI0oRiX1y
InChI InChI=1S/C20H20Cl2O5/c1-3-27-20(26)16-9-13(8-12(18(16)24)5-4-6-21)19(25)15-10-14(22)7-11(2)17(15)23/h7-10,23-24H,3-6H2,1-2H3
InChIKey WEPLWXUFBNCDOZ-UHFFFAOYSA-N
Mol Weight 411.28 g/mol
Molecular Formula C20H20Cl2O5
Exact Mass 410.068779 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 G8PqloQrPKS
Name Ethyl 3-(3-chloropropyl)-2-hydroxy-5-(2-hydroxy-5-chloro-3-methylbenzoyl)benzoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H20Cl2O5
InChI InChI=1S/C20H20Cl2O5/c1-3-27-20(26)16-9-13(8-12(18(16)24)5-4-6-21)19(25)15-10-14(22)7-11(2)17(15)23/h7-10,23-24H,3-6H2,1-2H3
InChIKey WEPLWXUFBNCDOZ-UHFFFAOYSA-N
Molecular Weight 411.281 g/mol
SMILES Oc1c(C(c2cc(c(c(c2)CCCCl)O)C(=O)OCC)=O)cc(cc1C)Cl
SPLASH splash10-01di-9552400000-fc030b53a402bfa69d17
Source of Spectrum F-62-7680-10
Synonyms Ethyl 5-(5-chloro-2-hydroxy-3-methylbenzoyl)-3-(3-chloropropyl)-2-hydroxybenzoate
Wiley ID 1640338