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AEP-CHMINACA
SpectraBase Compound ID Cf3l9qZXuSr
InChI InChI=1S/C20H28N4O2/c1-2-8-16(19(21)25)22-20(26)18-15-11-6-7-12-17(15)24(23-18)13-14-9-4-3-5-10-14/h6-7,11-12,14,16H,2-5,8-10,13H2,1H3,(H2,21,25)(H,22,26)/t16-/m0/s1
InChIKey FOGBYCHIDCWXCE-INIZCTEOSA-N
Mol Weight 356.47 g/mol
Molecular Formula C20H28N4O2
Exact Mass 356.221226 g/mol

Raman Spectrum

Raman Spectrum

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SpectraBase Spectrum ID HEBSREaKrBC
Name AEP-CHMINACA
Source of Sample Cayman Chemical Company
Catalog Number 23706
Cell Type Neat on gold post
Copyright Copyright © 2015-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H28N4O2
IUPAC Name (S)-N-(1-Amino-1-oxopentan-2-yl)-1-(cyclohexylmethyl)-1H-indazole-3-carboxamide
InChI InChI=1S/C20H28N4O2/c1-2-8-16(19(21)25)22-20(26)18-15-11-6-7-12-17(15)24(23-18)13-14-9-4-3-5-10-14/h6-7,11-12,14,16H,2-5,8-10,13H2,1H3,(H2,21,25)(H,22,26)/t16-/m0/s1
InChIKey FOGBYCHIDCWXCE-INIZCTEOSA-N
Molecular Weight 356.470 g/mol
Purity >=98%
Raman Corrections Referenced to internal white light source; 180 degree backscatter
Raman Laser Source Nd:YAG
SMILES N(C(c1c2c([n](n1)CC1CCCCC1)cccc2)=O)[C@](C(N)=O)(CCC)[H]
Scans Performed 1536
Source of Spectrum Forensic Spectral Research
Synonyms AB-CHMINACA isomer 1
Technique FT-Raman
UV - Neutral Conditions UVmax (nm): 210