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3-(2'-Nitroethyl)-4-[3'-hydroxy-1'-propyn-1'-yl]indole
SpectraBase Compound ID 2ZMPxyqNWx7
InChI InChI=1S/C13H12N2O3/c16-8-2-4-10-3-1-5-12-13(10)11(9-14-12)6-7-15(17)18/h1,3,5,9,14,16H,6-8H2
InChIKey PAQZYCFWMPFNOB-UHFFFAOYSA-N
Mol Weight 244.25 g/mol
Molecular Formula C13H12N2O3
Exact Mass 244.084792 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ey45u8VKfnq
Name 3-(2'-Nitroethyl)-4-[3'-hydroxy-1'-propyn-1'-yl]indole
Alternate Name(s) 4-(3-Hydroxypropynyl)-3-(2-nitroethyl)indole 3-[3-(2-nitroethyl)-1H-indol-4-yl]-2-propyn-1-ol
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Formula C13H12N2O3
InChI InChI=1S/C13H12N2O3/c16-8-2-4-10-3-1-5-12-13(10)11(9-14-12)6-7-15(17)18/h1,3,5,9,14,16H,6-8H2
InChIKey PAQZYCFWMPFNOB-UHFFFAOYSA-N
Molecular Weight 244.250 g/mol
SMILES [nH]1c2c(c(C#CCO)ccc2)c(CCN(=O)=O)c1
SPLASH splash10-0006-0390000000-f63ef3ca5a9d59195cd0
Source of Spectrum U-1997-1974-25
Wiley ID 770171