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3-[3-(dimethylamino)prop-1-ynyl]-5-(3-hydroxyprop-1-ynyl)-1-indazolecarboxylic acid tert-butyl ester
SpectraBase Compound ID 2foIvedPUA7
InChI InChI=1S/C20H23N3O3/c1-20(2,3)26-19(25)23-18-11-10-15(8-7-13-24)14-16(18)17(21-23)9-6-12-22(4)5/h10-11,14,24H,12-13H2,1-5H3
InChIKey JMXLUWMDSKWVIU-UHFFFAOYSA-N
Mol Weight 353.42 g/mol
Molecular Formula C20H23N3O3
Exact Mass 353.173942 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Efb4XKGBWDd
Name 3-[3-(dimethylamino)prop-1-ynyl]-5-(3-hydroxyprop-1-ynyl)-1-indazolecarboxylic acid tert-butyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H23N3O3
InChI InChI=1S/C20H23N3O3/c1-20(2,3)26-19(25)23-18-11-10-15(8-7-13-24)14-16(18)17(21-23)9-6-12-22(4)5/h10-11,14,24H,12-13H2,1-5H3
InChIKey JMXLUWMDSKWVIU-UHFFFAOYSA-N
Molecular Weight 353.422 g/mol
SMILES OCC#Cc1cc2c(n[n](c2cc1)C(=O)OC(C)(C)C)C#CCN(C)C
SPLASH splash10-114i-5092000000-c05e56cae331c0472936
Source of Spectrum C5-2005-777-8
Synonyms tert-Butyl 3-[3-(dimethylamino)prop-1-ynyl]-5-(3-hydroxyprop-1-ynyl)indazole-1-carboxylate tert-Butyl 3-[3-(dimethylamino)prop-1-ynyl]-5-(3-oxidanylprop-1-ynyl)indazole-1-carboxylate
Wiley ID 1618260