Systematic / IUPAC Name: Methyl N-{[1-(cyclohexylmethyl)-1H-indol-3-yl]carbonyl}-3-methyl-L-valinate
ID: Reference5103
Other Names:
L-Valine, N-{[1-(cyclohexylmethyl)-1H-indol-3-yl]carbonyl}-3-methyl, methyl ester ;
Methyl (S)-2-{1-(cyclohexylmethyl)-1H-indole-3-carboxamido}-3,3-dimethylbutanoate ;
MMB-CHMINACA
Formula: C23H32N2O3
Class: Drugs of Abuse/Illegal Drugs Sports Doping Drugs
MDMB-CHMICA mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.
Used Instruments | Orbitrap Fusion with FAIMS ; Q Exactive Plus Orbitrap |
No. of Spectral Trees | 3 |
No. of Spectra | 1311 |
Tandem Spectra | MS1, MS2, MS3, MS4 |
Ionization Methods | ESI; NSI |
Analyzers | FT |
Last Modification | 12/18/2018 10:31:59 AM |
InChI | InChI=1S/C23H32N2O3/c1-23(2,3)20(22(27)28-4)24-21(26)18-15-25(14-16-10-6-5-7-11-16)19-13-9-8-12-17(18)19/h8-9,12-13,15-16,20H,5-7,10-11,14H2,1-4H3,(H,24,26)/t20-/m1/s1 |
InChI Key | SRJKCVHWIDFUBO-HXUWFJFHSA-N |
Canonical SMILES | O=C(N[C@H](C(OC)=O)C(C)(C)C)C1=CN(CC2CCCCC2)C3=C1C=CC=C3 |
CAS | |
Splash | |
Other Names |
L-Valine, N-{[1-(cyclohexylmethyl)-1H-indol-3-yl]carbonyl}-3-methyl, methyl ester ; Methyl (S)-2-{1-(cyclohexylmethyl)-1H-indole-3-carboxamido}-3,3-dimethylbutanoate ; MMB-CHMINACA |
ChemSpider | 34450863 |
Wikipedia | MDMB-CHMICA |
PubChem | 119058045 |