![Benzenemethanaminium, N-[2-[[3-[4-(1,1-dimethylpropyl)-phenyl]-2-methylpropyl]methylamino]cyclohexyl]-N,N-dimethyl-, bromide salt](/api/spectrum/3cEo5ErVKI0/structure.png?h=300&w=458 "Benzenemethanaminium, N-[2-[[3-[4-(1,1-dimethylpropyl)-phenyl]-2-methylpropyl]methylamino]cyclohexyl]-N,N-dimethyl-, bromide salt")
| SpectraBase Compound ID | 5nWyFjfLY5u |
|---|---|
| InChI | InChI=1S/C31H49N2.BrH/c1-8-31(3,4)28-20-18-26(19-21-28)22-25(2)23-32(5)29-16-12-13-17-30(29)33(6,7)24-27-14-10-9-11-15-27;/h9-11,14-15,18-21,25,29-30H,8,12-13,16-17,22-24H2,1-7H3;1H/q+1;/p-1 |
| InChIKey | KSTJOWPIXUNHBY-UHFFFAOYSA-M |
| Mol Weight | 529.651 g/mol |
| Molecular Formula | C31H49BrN2 |
| Exact Mass | 528.307913 g/mol |
Transmission Infrared (IR) Spectrum
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| SpectraBase Spectrum ID | 3cEo5ErVKI0 |
|---|---|
| Name | Benzenemethanaminium, N-[2-[[3-[4-(1,1-dimethylpropyl)-phenyl]-2-methylpropyl]methylamino]cyclohexyl]-N,N-dimethyl-, bromide salt |
| CAS Registry Number | 88572-78-5 |
| Copyright | Copyright © 1989, 1990-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C31H49BrN2 |
| InChI | InChI=1S/C31H49N2.BrH/c1-8-31(3,4)28-20-18-26(19-21-28)22-25(2)23-32(5)29-16-12-13-17-30(29)33(6,7)24-27-14-10-9-11-15-27;/h9-11,14-15,18-21,25,29-30H,8,12-13,16-17,22-24H2,1-7H3;1H/q+1;/p-1 |
| InChIKey | KSTJOWPIXUNHBY-UHFFFAOYSA-M |
| Instrument Name | Bruker IFS 112 |
| Technique | KBr-Pellet |