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2-methyl-3-phenethoxyisoindolin-1-one
SpectraBase Compound ID 6c8gLp5gScw
InChI InChI=1S/C17H17NO2/c1-18-16(19)14-9-5-6-10-15(14)17(18)20-12-11-13-7-3-2-4-8-13/h2-10,17H,11-12H2,1H3
InChIKey YYWJWSBHEMWYNR-UHFFFAOYSA-N
Mol Weight 267.33 g/mol
Molecular Formula C17H17NO2
Exact Mass 267.125929 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AjN3Zi4yjII
Name 2-methyl-3-phenethoxyisoindolin-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 267.125928789 u
Formula C17H17NO2
InChI InChI=1S/C17H17NO2/c1-18-16(19)14-9-5-6-10-15(14)17(18)20-12-11-13-7-3-2-4-8-13/h2-10,17H,11-12H2,1H3
InChIKey YYWJWSBHEMWYNR-UHFFFAOYSA-N
Instrument Name Agilent 5973
Ionization Type EI
Literature Reference DOI 10.1002/anie.201508575
Molecular Weight 267.328 g/mol
Quality 73
Reported Formula C17H17O2N
SMILES CN1C(C2=C(C1OCCC1=CC=CC=C1)C=CC=C2)=O
SPLASH splash10-0002-0900000000-9576e6e40548b19d53c7
Source of Spectrum ACI-55-SM22-8g (DOI: 10.1002/anie.201508575)
Wiley ID 1895075