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5-Methoxy-2-(octan-2-yl)-1-(pyridin-2-yl)-1H-indole
SpectraBase Compound ID GUMJam9UNnO
InChI InChI=1S/C22H28N2O/c1-4-5-6-7-10-17(2)21-16-18-15-19(25-3)12-13-20(18)24(21)22-11-8-9-14-23-22/h8-9,11-17H,4-7,10H2,1-3H3
InChIKey VAWULAUWPRFOHH-UHFFFAOYSA-N
Mol Weight 336.48 g/mol
Molecular Formula C22H28N2O
Exact Mass 336.220164 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ApqYLJYbIxR
Name 5-Methoxy-2-(octan-2-yl)-1-(pyridin-2-yl)-1H-indole
Appearance Colorless oil
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Exact Mass 336.220163529 u
Formula C22H28N2O
InChI InChI=1S/C22H28N2O/c1-4-5-6-7-10-17(2)21-16-18-15-19(25-3)12-13-20(18)24(21)22-11-8-9-14-23-22/h8-9,11-17H,4-7,10H2,1-3H3
InChIKey VAWULAUWPRFOHH-UHFFFAOYSA-N
Instrument Name Finnigan MAT 95
Ionization Type EI
Literature Reference DOI 10.1002/anie.201704196
Molecular Weight 336.479 g/mol
Reported Formula C22H28N2O
SMILES COC1=CC2=C(C=C1)N(C(=C2)C(C)CCCCCC)C1=NC=CC=C1
SPLASH splash10-0f79-0093000000-144d414ad5f3f0f1c328
Source of Spectrum ACI-56-SM20-4ba (DOI: 10.1002/anie.201704196)
Wiley ID 1896273