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6a,7,8,9,10,10a-Hexahydro-6-(4-methoxybenzyl)-11-trifluoromethyl-6H-pyrido[4,3-b]carbazole
SpectraBase Compound ID AIfwGVCjqCj
InChI InChI=1S/C24H23F3N2O/c1-30-17-8-6-15(7-9-17)14-29-20-5-3-2-4-18(20)22-21(29)12-16-10-11-28-13-19(16)23(22)24(25,26)27/h6-13,18,20H,2-5,14H2,1H3
InChIKey UBBBGLUBIAAYST-UHFFFAOYSA-N
Mol Weight 412.46 g/mol
Molecular Formula C24H23F3N2O
Exact Mass 412.176248 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BS04LBIYXIn
Name 6a,7,8,9,10,10a-Hexahydro-6-(4-methoxybenzyl)-11-trifluoromethyl-6H-pyrido[4,3-b]carbazole
Alternate Name(s) 6-(4-methoxybenzyl)-11-(trifluoromethyl)-6a,7,8,9,10,10a-hexahydro-6H-pyrido[4,3-b]carbazole methyl 4-{[11-(trifluoromethyl)-6a,7,8,9,10,10a-hexahydro-6H-pyrido[4,3-b]carbazol-6-yl]methyl}phenyl ether
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H23F3N2O
InChI InChI=1S/C24H23F3N2O/c1-30-17-8-6-15(7-9-17)14-29-20-5-3-2-4-18(20)22-21(29)12-16-10-11-28-13-19(16)23(22)24(25,26)27/h6-13,18,20H,2-5,14H2,1H3
InChIKey UBBBGLUBIAAYST-UHFFFAOYSA-N
Molecular Weight 412.456 g/mol
SMILES c12N(C3CCCCC3c1c(c1c(c2)ccnc1)C(F)(F)F)Cc1ccc(cc1)OC
SPLASH splash10-00di-0900100000-57eae95b0ea7edf991f5
Source of Spectrum H1-41-1454-3
Wiley ID 757352