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MMB-FUBGACLONE
SpectraBase Compound ID 16nx2toJ1Fx
InChI InChI=1S/C24H23FN2O3/c1-15(2)22(24(29)30-3)26-13-12-20-21(23(26)28)18-6-4-5-7-19(18)27(20)14-16-8-10-17(25)11-9-16/h4-13,15,22H,14H2,1-3H3
InChIKey XSCMLYYWYYHBHR-UHFFFAOYSA-N
Mol Weight 406.46 g/mol
Molecular Formula C24H23FN2O3
Exact Mass 406.169271 g/mol

Attenuated Total Reflectance Infrared (ATR-IR) Spectrum

Attenuated Total Reflectance Infrared (ATR-IR) Spectrum

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SpectraBase Spectrum ID 6F0cPQrjOcb
Name MMB-FUBGACLONE
Source of Sample Cayman Chemical Company
Catalog Number 30770
Lot Number 0609955-5
Accessory DurasamplIR II
Apodization Function Norton-Beer, medium
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Formula C24H23FN2O3
IUPAC Name Methyl 2-(5-(4-fluorobenzyl)-1-oxo-1,5-dihydro-2H-pyrido[4,3-b]indol-2-yl)-3-methylbutanoate
InChI InChI=1S/C24H23FN2O3/c1-15(2)22(24(29)30-3)26-13-12-20-21(23(26)28)18-6-4-5-7-19(18)27(20)14-16-8-10-17(25)11-9-16/h4-13,15,22H,14H2,1-3H3
InChIKey XSCMLYYWYYHBHR-UHFFFAOYSA-N
Instrument Name Bio-Rad FTS
Molecular Weight 406.457 g/mol
Purity >=98%
SMILES C(N1C=Cc2c(C1=O)c1c([n]2Cc2ccc(cc2)F)cccc1)(C(C)C)C(OC)=O
Scan Speed (number) 5
Source of Spectrum Forensic Spectral Research
Technique ATR-Neat
UV - Neutral Conditions UVmax (nm): 244, 250