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5,8-Diacetoxy-3-dimethylamino-7-methoxyisoquinoline iodomethylate
SpectraBase Compound ID LaxcAQHk6f5
InChI InChI=1S/C17H21N2O5.HI/c1-10(20)23-14-8-15(22-6)17(24-11(2)21)13-9-19(5)16(18(3)4)7-12(13)14;/h7-9H,1-6H3;1H/q+1;/p-1
InChIKey DTBSJZYHUMUEKJ-UHFFFAOYSA-M
Mol Weight 460.27 g/mol
Molecular Formula C17H21IN2O5
Exact Mass 460.049517 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CJTiXfrJGZM
Name 5,8-Diacetoxy-3-dimethylamino-7-methoxyisoquinoline iodomethylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H21IN2O5
InChI InChI=1S/C17H21N2O5.HI/c1-10(20)23-14-8-15(22-6)17(24-11(2)21)13-9-19(5)16(18(3)4)7-12(13)14;/h7-9H,1-6H3;1H/q+1;/p-1
InChIKey DTBSJZYHUMUEKJ-UHFFFAOYSA-M
Molecular Weight 460.268 g/mol
SMILES [I-].c1([n+](cc2c(c1)c(cc(c2OC(=O)C)OC)OC(=O)C)C)N(C)C
SPLASH splash10-00lr-0191000000-2e009a28cef9df6d33bf
Source of Spectrum Y-15-571-0
Synonyms 5,8-bis(acetyloxy)-3-(dimethylamino)-7-methoxy-2-methylisoquinolinium iodide
Wiley ID 1390374