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1-(3-isoquinolinyl)-2-methyl-1-propanone
SpectraBase Compound ID 43xGRvBR8Xh
InChI InChI=1S/C13H13NO/c1-9(2)13(15)12-7-10-5-3-4-6-11(10)8-14-12/h3-9H,1-2H3
InChIKey AGJNXFVBASKFNF-UHFFFAOYSA-N
Mol Weight 199.25 g/mol
Molecular Formula C13H13NO
Exact Mass 199.099714 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8NDRNYXpAUS
Name 1-(3-isoquinolinyl)-2-methyl-1-propanone
Alternate Name(s) 1-(3-isoquinolyl)-2-methyl-propan-1-one 1-isoquinolin-3-yl-2-methyl-propan-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H13NO
InChI InChI=1S/C13H13NO/c1-9(2)13(15)12-7-10-5-3-4-6-11(10)8-14-12/h3-9H,1-2H3
InChIKey AGJNXFVBASKFNF-UHFFFAOYSA-N
Molecular Weight 199.253 g/mol
SMILES C(C(C)C)(c1ncc2c(c1)cccc2)=O
SPLASH splash10-004i-1900000000-16e685432d402755dab4
Source of Spectrum KD-12-1193-6
Wiley ID 1634392