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

*Links on SpectraBase are not permalinks.
4-(Carboxychloromethyl)-4-(2,3-dimethoxyphenyl)-1-methyl-3-methylene-2-piperidinone
SpectraBase Compound ID AOzuryOl6pW
InChI InChI=1S/C17H20ClNO5/c1-10-15(20)19(2)9-8-17(10,14(18)16(21)22)11-6-5-7-12(23-3)13(11)24-4/h5-7,14H,1,8-9H2,2-4H3,(H,21,22)
InChIKey KPZRMWHPZDNTHY-UHFFFAOYSA-N
Mol Weight 353.8 g/mol
Molecular Formula C17H20ClNO5
Exact Mass 353.103 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 Bb9wYH8QJnw
Name 4-(Carboxychloromethyl)-4-(2,3-dimethoxyphenyl)-1-methyl-3-methylene-2-piperidinone
CAS Registry Number 79619-09-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H20ClNO5
InChI InChI=1S/C17H20ClNO5/c1-10-15(20)19(2)9-8-17(10,14(18)16(21)22)11-6-5-7-12(23-3)13(11)24-4/h5-7,14H,1,8-9H2,2-4H3,(H,21,22)
InChIKey KPZRMWHPZDNTHY-UHFFFAOYSA-N
Molecular Weight 353.802 g/mol
SMILES OC(C(C1(C(C(=O)N(CC1)C)=C)c1c(c(OC)ccc1)OC)Cl)=O
SPLASH splash10-03di-0092000000-6695fcffe4c2c2906faa
Source of Spectrum J-46-5071-0
Synonyms Chloro[4-(2,3-dimethoxyphenyl)-1-methyl-3-methylene-2-oxo-4-piperidinyl]acetic acid
Wiley ID 1343844