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1-isopropyl-2H-isoquinolin-3-one

View entire compound with spectra: 1 MS (GC)

1-isopropyl-2H-isoquinolin-3-one
SpectraBase Compound ID AyF8y7sM2pZ
InChI InChI=1S/C12H13NO/c1-8(2)12-10-6-4-3-5-9(10)7-11(14)13-12/h3-8H,1-2H3,(H,13,14)
InChIKey YADKYOJGMQFPBX-UHFFFAOYSA-N
Mol Weight 187.24 g/mol
Molecular Formula C12H13NO
Exact Mass 187.099714 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7fzimAdj6a4
Name 1-isopropyl-2H-isoquinolin-3-one
Alternate Name(s) 1-isopropyl-3-isoquinolone 1-Propan-2-yl-2H-isoquinolin-3-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H13NO
InChI InChI=1S/C12H13NO/c1-8(2)12-10-6-4-3-5-9(10)7-11(14)13-12/h3-8H,1-2H3,(H,13,14)
InChIKey YADKYOJGMQFPBX-UHFFFAOYSA-N
Molecular Weight 187.242 g/mol
SMILES N1C(C=C2C(=C1C(C)C)C=CC=C2)=O
SPLASH splash10-000i-0900000000-51caa7bb7492fc607456
Source of Spectrum AJ-41-981-2
Wiley ID 1567720