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

*Links on SpectraBase are not permalinks.
Dimethyl (E)-2-(4-chloro-1-(naphth-1-yl)-4-phenylbut-3-en-2-yl)malonate
SpectraBase Compound ID F7x8XttiGi
InChI InChI=1S/C25H23ClO4/c1-29-24(27)23(25(28)30-2)20(16-22(26)18-10-4-3-5-11-18)15-19-13-8-12-17-9-6-7-14-21(17)19/h3-14,16,20,23H,15H2,1-2H3/b22-16+
InChIKey LLKDQXIDYAINRU-CJLVFECKSA-N
Mol Weight 422.91 g/mol
Molecular Formula C25H23ClO4
Exact Mass 422.128487 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 3FdrvABJFCx
Name Dimethyl (E)-2-(4-chloro-1-(naphth-1-yl)-4-phenylbut-3-en-2-yl)malonate
Appearance Colorless thick oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 422.128486917 u
Formula C25H23ClO4
InChI InChI=1S/C25H23ClO4/c1-29-24(27)23(25(28)30-2)20(16-22(26)18-10-4-3-5-11-18)15-19-13-8-12-17-9-6-7-14-21(17)19/h3-14,16,20,23H,15H2,1-2H3/b22-16+
InChIKey LLKDQXIDYAINRU-CJLVFECKSA-N
Ionization Type EI
Literature Reference DOI 10.1002/anie.201803541
Molecular Weight 422.908 g/mol
Quality 176
Reported Formula C25H23ClO4
SMILES COC(C(C(=O)OC)C(\C=C/(C1=CC=CC=C1)Cl)CC1=C2C(=CC=C1)C=CC=C2)=O
SPLASH splash10-00kf-0900000000-e1a67586d2876d154322
Source of Spectrum ACI-57-SM18-6t (DOI: 10.1002/anie.201803541)
Wiley ID 1893197