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1(2H)-Isoquinolinone, 3,4-dihydro-2-[(2-methylphenyl)methyl]-
SpectraBase Compound ID Ej4kmTBn8nu
InChI InChI=1S/C17H17NO/c1-13-6-2-3-8-15(13)12-18-11-10-14-7-4-5-9-16(14)17(18)19/h2-9H,10-12H2,1H3
InChIKey VKMQTCHRQIOXMO-UHFFFAOYSA-N
Mol Weight 251.33 g/mol
Molecular Formula C17H17NO
Exact Mass 251.131014 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3AXBN4TOynL
Name 1(2H)-Isoquinolinone, 3,4-dihydro-2-[(2-methylphenyl)methyl]-
Alternate Name(s) 2-(2-Methylbenzyl)-3,4-dihydro-1(2H)-isoquinolinone
CAS Registry Number 116351-63-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H17NO
InChI InChI=1S/C17H17NO/c1-13-6-2-3-8-15(13)12-18-11-10-14-7-4-5-9-16(14)17(18)19/h2-9H,10-12H2,1H3
InChIKey VKMQTCHRQIOXMO-UHFFFAOYSA-N
Molecular Weight 251.329 g/mol
SMILES C1(N(Cc2c(C)cccc2)CCc2c1cccc2)=O
SPLASH splash10-0udi-0980000000-e6433a413c4f7803ca37
Source of Spectrum J-53-5126-84
Wiley ID 1254791