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3-Isopropyl-1,5-bis(9H-xanthen-9-yl)indole
SpectraBase Compound ID 15BAgc7u2OH
InChI InChI=1S/C37H29NO2/c1-23(2)30-22-38(37-27-13-5-9-17-34(27)40-35-18-10-6-14-28(35)37)31-20-19-24(21-29(30)31)36-25-11-3-7-15-32(25)39-33-16-8-4-12-26(33)36/h3-23,36-37H,1-2H3
InChIKey KWXOSBJLFVLGKT-UHFFFAOYSA-N
Mol Weight 519.6 g/mol
Molecular Formula C37H29NO2
Exact Mass 519.219829 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2jN5UTfh0uy
Name 3-Isopropyl-1,5-bis(9H-xanthen-9-yl)indole
Alternate Name(s) 3-propan-2-yl-1,5-bis(9H-xanthen-9-yl)indole
CAS Registry Number 120105-00-2
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C37H29NO2
InChI InChI=1S/C37H29NO2/c1-23(2)30-22-38(37-27-13-5-9-17-34(27)40-35-18-10-6-14-28(35)37)31-20-19-24(21-29(30)31)36-25-11-3-7-15-32(25)39-33-16-8-4-12-26(33)36/h3-23,36-37H,1-2H3
InChIKey KWXOSBJLFVLGKT-UHFFFAOYSA-N
Molecular Weight 519.644 g/mol
SMILES C1([n]2cc(C(C)C)c3c2ccc(C2c4c(cccc4)Oc4c2cccc4)c3)c2c(cccc2)Oc2c1cccc2
SPLASH splash10-001i-0900000000-e8d6622eaaffb2e1faa3
Source of Spectrum Y-25-1202-10
Wiley ID 1401861