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3-Isopropyl-1-(9H-xanthen-9-yl)indole
SpectraBase Compound ID CSCE84j3xli
InChI InChI=1S/C24H21NO/c1-16(2)20-15-25(21-12-6-3-9-17(20)21)24-18-10-4-7-13-22(18)26-23-14-8-5-11-19(23)24/h3-16,24H,1-2H3
InChIKey VTKWVPRKHHULGP-UHFFFAOYSA-N
Mol Weight 339.44 g/mol
Molecular Formula C24H21NO
Exact Mass 339.162314 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Lr94VxsIvgp
Name 3-Isopropyl-1-(9H-xanthen-9-yl)indole
Alternate Name(s) 3-propan-2-yl-1-(9H-xanthen-9-yl)indole
CAS Registry Number 120104-95-2
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H21NO
InChI InChI=1S/C24H21NO/c1-16(2)20-15-25(21-12-6-3-9-17(20)21)24-18-10-4-7-13-22(18)26-23-14-8-5-11-19(23)24/h3-16,24H,1-2H3
InChIKey VTKWVPRKHHULGP-UHFFFAOYSA-N
Molecular Weight 339.438 g/mol
SMILES C1([n]2cc(C(C)C)c3c2cccc3)c2c(cccc2)Oc2c1cccc2
SPLASH splash10-001i-0900000000-a9dcb30e068bc03d9254
Source of Spectrum Y-25-1201-5
Wiley ID 1334714