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2-Acetonyl-3,4-dihydroisoquinolinium-perchlorate
SpectraBase Compound ID 4qLJhCtIhne
InChI InChI=1S/C12H14NO.ClHO4/c1-10(14)8-13-7-6-11-4-2-3-5-12(11)9-13;2-1(3,4)5/h2-5,9H,6-8H2,1H3;(H,2,3,4,5)/q+1;/p-1
InChIKey BAHLZGXCYQDRAO-UHFFFAOYSA-M
Mol Weight 287.7 g/mol
Molecular Formula C12H14ClNO5
Exact Mass 287.05605 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Fu8G76BnyHa
Name 2-Acetonyl-3,4-dihydroisoquinolinium-perchlorate
Alternate Name(s) 2-(2-oxopropyl)-3,4-dihydroisoquinolin-2-ium perchlorate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H14ClNO5
InChI InChI=1S/C12H14NO.ClHO4/c1-10(14)8-13-7-6-11-4-2-3-5-12(11)9-13;2-1(3,4)5/h2-5,9H,6-8H2,1H3;(H,2,3,4,5)/q+1;/p-1
InChIKey BAHLZGXCYQDRAO-UHFFFAOYSA-M
Literature Reference DOI 10.1002/ardp.19863190407
Molecular Weight 287.699 g/mol
SMILES C(C(=O)C)[N+]1=Cc2ccccc2CC1.[Cl](=O)(=O)(=O)[O-]
SPLASH splash10-00ku-0900000000-4a2a6b19bee71feac4df
Source of Spectrum APC-319-329-4
Wiley ID 1788256