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3-METHYLISOQUINOLIN-N-OXID
SpectraBase Compound ID KKcmUVc50Xh
InChI InChI=1S/C10H9NO/c1-8-6-9-4-2-3-5-10(9)7-11(8)12/h2-7H,1H3
InChIKey BTEXQKZNRLDUMG-UHFFFAOYSA-N
Mol Weight 159.19 g/mol
Molecular Formula C10H9NO
Exact Mass 159.068414 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CkvtLFEdOdL
Name Isoquinoline, 3-methyl-, 2-oxide
Alternate Name(s) 3-Methylisoquinoline 2-oxide 3-Methyl-2-oxidanidyl-isoquinolin-2-ium 3-Methyl-2-oxido-isoquinolin-2-ium 3-Methylisoquinoline N-oxide
CAS Registry Number 14548-00-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H9NO
InChI InChI=1S/C10H9NO/c1-8-6-9-4-2-3-5-10(9)7-11(8)12/h2-7H,1H3
InChIKey BTEXQKZNRLDUMG-UHFFFAOYSA-N
Molecular Weight 159.188 g/mol
SMILES CC1=Cc2c(cccc2)[CH-][N+]1=O
SPLASH splash10-0006-5900000000-b4ce722578da5cc5ab7b
Source of Spectrum SD-1981-0-0
Wiley ID 1156255