For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
Ethylbenzyl-PeGACLONE
SpectraBase Compound ID 52Pk7Do7Wgo
InChI InChI=1S/C25H28N2O/c1-3-5-11-17-26-22-15-10-9-14-20(22)24-23(26)16-18-27(25(24)28)21(4-2)19-12-7-6-8-13-19/h6-10,12-16,18,21H,3-5,11,17H2,1-2H3
InChIKey OYGBCKBLQHHWFJ-UHFFFAOYSA-N
Mol Weight 372.51 g/mol
Molecular Formula C25H28N2O
Exact Mass 372.220164 g/mol

Raman Spectrum

Raman Spectrum

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 8N5Ovf6Bzqz
Name Ethylbenzyl-PeGACLONE
Source of Sample Cayman Chemical Company
Catalog Number 9003353
Cell Type Capillary tube
Copyright Copyright © 2015-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H28N2O
IUPAC Name 5-Pentyl-2-(1-phenylpropyl)-2,5-dihydro-1H-pyrido[4,3-b]indol-1-one
InChI InChI=1S/C25H28N2O/c1-3-5-11-17-26-22-15-10-9-14-20(22)24-23(26)16-18-27(25(24)28)21(4-2)19-12-7-6-8-13-19/h6-10,12-16,18,21H,3-5,11,17H2,1-2H3
InChIKey OYGBCKBLQHHWFJ-UHFFFAOYSA-N
Molecular Weight 372.512 g/mol
Purity >=98%
Raman Corrections Referenced to internal white light source; 180 degree backscatter
Raman Laser Source Nd:YAG
SMILES C(N1C=Cc2c(C1=O)c1c([n]2CCCCC)cccc1)(c1ccccc1)CC
Scans Performed 1408
Source of Spectrum Forensic Spectral Research
Synonyms CUMYL PeGACLONE Ethylbenzyl isomer
Technique FT-Raman
UV - Neutral Conditions UVmax (nm): 251