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4-cyano CUMYL-BUTCZCA
SpectraBase Compound ID 8Fq4FLPjmwy
InChI InChI=1S/C27H27N3O/c1-27(2,21-11-5-3-6-12-21)29-26(31)20-15-16-25-23(19-20)22-13-7-8-14-24(22)30(25)18-10-4-9-17-28/h3,5-8,11-16,19H,4,9-10,18H2,1-2H3,(H,29,31)
InChIKey ZSRKLDXCDUXUKY-UHFFFAOYSA-N
Mol Weight 409.53 g/mol
Molecular Formula C27H27N3O
Exact Mass 409.215413 g/mol

Raman Spectrum

Raman Spectrum

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SpectraBase Spectrum ID CV9Y1qEBu5b
Name 4-Cyano CUMYL-BUTCZCA
Source of Sample Cayman Chemical Company
Catalog Number 24429
Cell Type Capillary tube
Copyright Copyright © 2015-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H27N3O
IUPAC Name 9-(4-Cyanobutyl)-N-(2-phenylpropan-2-yl)-9H-carbazole-3-carboxamide
InChI InChI=1S/C27H27N3O/c1-27(2,21-11-5-3-6-12-21)29-26(31)20-15-16-25-23(19-20)22-13-7-8-14-24(22)30(25)18-10-4-9-17-28/h3,5-8,11-16,19H,4,9-10,18H2,1-2H3,(H,29,31)
InChIKey ZSRKLDXCDUXUKY-UHFFFAOYSA-N
Molecular Weight 409.533 g/mol
Purity >=98%
Raman Corrections Referenced to internal white light source; 180 degree backscatter
Raman Laser Source Nd:YAG
SMILES N(C(c1ccc2c(c3c([n]2CCCCC#N)cccc3)c1)=O)C(c1ccccc1)(C)C
Scans Performed 768
Source of Spectrum Forensic Spectral Research
Synonyms CUMYL-4CN-BCZCA; CUMYL-4-Cyano BUTCZCA, CUMYL-CYBCZCA
Technique FT-Raman
UV - Neutral Conditions UVmax (nm): 236, 244, 277