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1,4-Dihydro-2-methyl-1,4-ethanoisoquinolin-3(2H)-one
SpectraBase Compound ID 8WAVaVAGhjI
InChI InChI=1S/C12H13NO/c1-13-11-7-6-10(12(13)14)8-4-2-3-5-9(8)11/h2-5,10-11H,6-7H2,1H3/t10-,11+/m0/s1
InChIKey UETKTLAHRQIXBC-WDEREUQCSA-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 B1dfxp5CRuq
Name 1,4-Dihydro-2-methyl-1,4-ethanoisoquinolin-3(2H)-one
CAS Registry Number 3118-05-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H13NO
InChI InChI=1S/C12H13NO/c1-13-11-7-6-10(12(13)14)8-4-2-3-5-9(8)11/h2-5,10-11H,6-7H2,1H3/t10-,11+/m0/s1
InChIKey UETKTLAHRQIXBC-WDEREUQCSA-N
Molecular Weight 187.242 g/mol
SMILES CN1[C@@]2(CC[C@@](c3ccccc23)(C1=O)[H])[H]
SPLASH splash10-003r-1900000000-e27959df13738fc5a1cc
Source of Spectrum W5-1989-24662-1
Wiley ID 1183935