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1-tert-Butyl-4-(trifluoromethyl)-1H-pyrrolo[2,3-b]pyridine-3-carbonitrile
SpectraBase Compound ID EFyfFjfeGfO
InChI InChI=1S/C13H12F3N3/c1-12(2,3)19-7-8(6-17)10-9(13(14,15)16)4-5-18-11(10)19/h4-5,7H,1-3H3
InChIKey MZYMBYQKJOGFEE-UHFFFAOYSA-N
Mol Weight 267.26 g/mol
Molecular Formula C13H12F3N3
Exact Mass 267.098332 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GAqvTooJ2rS
Name 1-tert-Butyl-4-(trifluoromethyl)-1H-pyrrolo[2,3-b]pyridine-3-carbonitrile
Alternate Name(s) 1-tert-Butyl-4-(trifluoromethyl)-3-pyrrolo[2,3-b]pyridinecarbonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H12F3N3
InChI InChI=1S/C13H12F3N3/c1-12(2,3)19-7-8(6-17)10-9(13(14,15)16)4-5-18-11(10)19/h4-5,7H,1-3H3
InChIKey MZYMBYQKJOGFEE-UHFFFAOYSA-N
Molecular Weight 267.255 g/mol
SMILES c12[n](cc(c2c(C(F)(F)F)ccn1)C#N)C(C)(C)C
SPLASH splash10-03di-3190000000-f81a64ed5907bf442842
Source of Spectrum F4-41-1855-17
Wiley ID 1672356