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1H-Indole-3-acetic acid, 2-(1-oxo-7-octynyl)-, methyl ester
SpectraBase Compound ID BDAtLgjDGnB
InChI InChI=1S/C19H21NO3/c1-3-4-5-6-7-12-17(21)19-15(13-18(22)23-2)14-10-8-9-11-16(14)20-19/h1,8-11,20H,4-7,12-13H2,2H3
InChIKey YZGVQFMYOSBVDC-UHFFFAOYSA-N
Mol Weight 311.38 g/mol
Molecular Formula C19H21NO3
Exact Mass 311.152144 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID A7qDtXbDrfG
Name 1H-Indole-3-acetic acid, 2-(1-oxo-7-octynyl)-, methyl ester
CAS Registry Number 119837-90-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H21NO3
InChI InChI=1S/C19H21NO3/c1-3-4-5-6-7-12-17(21)19-15(13-18(22)23-2)14-10-8-9-11-16(14)20-19/h1,8-11,20H,4-7,12-13H2,2H3
InChIKey YZGVQFMYOSBVDC-UHFFFAOYSA-N
Molecular Weight 311.381 g/mol
SMILES [nH]1c2c(c(c1C(=O)CCCCCC#C)CC(=O)OC)cccc2
SPLASH splash10-03di-0029000000-78fdfb27ea67b630bee2
Source of Spectrum KC-1988-3253-7
Synonyms Methyl 2-(oct-7-ynoyl)indol-3-ylacetate Methyl[2-(7-octynoyl)-1H-indol-3-yl]acetate
Wiley ID 1312597