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3-[2-(5-benzoxy-1-oxido-3,6-dihydro-2H-pyridin-1-ium-1-yl)ethyl]-5-methoxy-1H-indole
SpectraBase Compound ID Ehybq3n6gOp
InChI InChI=1S/C23H26N2O3/c1-27-20-9-10-23-22(14-20)19(15-24-23)11-13-25(26)12-5-8-21(16-25)28-17-18-6-3-2-4-7-18/h2-4,6-10,14-15,24H,5,11-13,16-17H2,1H3
InChIKey YODFFKKEFRYXAV-UHFFFAOYSA-N
Mol Weight 378.47 g/mol
Molecular Formula C23H26N2O3
Exact Mass 378.194343 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HSg7yChs0OX
Name 3-[2-(5-benzoxy-1-oxido-3,6-dihydro-2H-pyridin-1-ium-1-yl)ethyl]-5-methoxy-1H-indole
Comments Less than 3 mono-isotopic peaks
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Formula C23H26N2O3
InChI InChI=1S/C23H26N2O3/c1-27-20-9-10-23-22(14-20)19(15-24-23)11-13-25(26)12-5-8-21(16-25)28-17-18-6-3-2-4-7-18/h2-4,6-10,14-15,24H,5,11-13,16-17H2,1H3
InChIKey YODFFKKEFRYXAV-UHFFFAOYSA-N
Molecular Weight 378.472 g/mol
SMILES [nH]1c2c(c(c1)CC[N+]1(CC(OCc3ccccc3)=CCC1)[O-])cc(cc2)OC
SPLASH splash10-0002-0900000000-c74d7f89c3ba864c1937
Source of Spectrum J-62-8270-8
Synonyms 3-[2-(5-benzyloxy-1-oxido-3,6-dihydro-2H-pyridin-1-ium-1-yl)ethyl]-5-methoxy-1H-indole 5-methoxy-3-[2-(1-oxidanidyl-5-phenylmethoxy-3,6-dihydro-2H-pyridin-1-ium-1-yl)ethyl]-1H-indole 5-methoxy-3-[2-(1-oxido-5-phenylmethoxy-3,6-dihydro-2H-pyridin-1-ium-1-yl)ethyl]-1H-indole
Wiley ID 1358960