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2-(2-(2-chloroethoxy)ethyl)-3-methoxyisoindolin-1-one
SpectraBase Compound ID 3dqvEzWcrpp
InChI InChI=1S/C13H16ClNO3/c1-17-13-11-5-3-2-4-10(11)12(16)15(13)7-9-18-8-6-14/h2-5,13H,6-9H2,1H3
InChIKey RWJHQKWBBMBGEO-UHFFFAOYSA-N
Mol Weight 269.73 g/mol
Molecular Formula C13H16ClNO3
Exact Mass 269.081871 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID G1hmo4roIAE
Name 2-(2-(2-chloroethoxy)ethyl)-3-methoxyisoindolin-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 269.081871076 u
Formula C13H16ClNO3
InChI InChI=1S/C13H16ClNO3/c1-17-13-11-5-3-2-4-10(11)12(16)15(13)7-9-18-8-6-14/h2-5,13H,6-9H2,1H3
InChIKey RWJHQKWBBMBGEO-UHFFFAOYSA-N
Instrument Name Agilent 5973
Ionization Type EI
Literature Reference DOI 10.1002/anie.201508575
Quality 180
Reported Formula C13H16O3NC
SMILES C(Cl)COCCN1C(C2=C(C1OC)C=CC=C2)=O
SPLASH splash10-002b-0930000000-a69044585ed17c673fcc
Source of Spectrum ACI-55-SM11-2g (DOI: 10.1002/anie.201508575)
Wiley ID 1895049