APP-CHMINACA

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Systematic / IUPAC Name: N-[(2S)-1-Amino-1-oxo-3-phenylpropan-2-yl]-1-(cyclohexylmethyl)indazole-3-carboxamide

ID: Reference5821

Other Names: 1H-Indazole-3-carboxamide, N-[(1S)-2-amino-2-oxo-1-(phenylmethyl)ethyl]-1-(cyclohexylmethyl)-;
Nα-{[1-(Cyclohexylmethyl)-1H-indazol-3-yl]carbonyl}-L-phenylalaninamide;
PX 3

Formula: C24H28N4O2

Class: Drugs of Abuse/Illegal Drugs

Spectral Data

APP-CHMINACA mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

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Available MS Data

Used Instruments Q Exactive Plus Orbitrap
No. of Spectral Trees 1
No. of Spectra 119
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 10/24/2016 12:45:19 PM
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Identificators

InChI InChI=1S/C24H28N4O2/c25-23(29)20(15-17-9-3-1-4-10-17)26-24(30)22-19-13-7-8-14-21(19)28(27-22)16-18-11-5-2-6-12-18/h1,3-4,7-10,13-14,18,20H,2,5-6,11-12,15-16H2,(H2,25,29)(H,26,30)/t20-/m0/s1
InChI Key DMHWDSGURMXMGE-FQEVSTJZSA-N
Canonical SMILES C1CCC(CC1)CN2C3=CC=CC=C3C(=N2)C(=O)NC(CC4=CC=CC=C4)C(=O)N
CAS 1185887142
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Other Names 1H-Indazole-3-carboxamide, N-[(1S)-2-amino-2-oxo-1-(phenylmethyl)ethyl]-1-(cyclohexylmethyl)-;
Nα-{[1-(Cyclohexylmethyl)-1H-indazol-3-yl]carbonyl}-L-phenylalaninamide;
PX 3

In Other Databases

Wikipedia PX-3
PubChem 44206137
ChemSpider 48063640