| SpectraBase Spectrum ID |
2gSY1qo8f0h |
| Name |
{[(p-Chlorophenyl)carbamoyl]methyl}dimethyl[(5,6,7,8-tetrahydro-2-naphthyl)methyl]ammoniun chloride |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
378.126568800 u |
| Formula |
C20H24Cl2N2O |
| InChI |
InChI=1S/C20H23ClN2O.ClH/c1-23(2,14-20(24)22-18-10-8-17(21)9-11-18)19-12-7-15-5-3-4-6-16(15)13-19;/h7-13H,3-6,14H2,1-2H3;1H |
| InChIKey |
VDMFTPAWIYBCFU-UHFFFAOYSA-N |
| SMILES |
[Cl-].N(C1=CC=C(C=C1)Cl)C(C[N+](C=1C=C2CCCCC2=CC1)(C)C)=O |
| Spectrum/Structure Validation Score (Raman) |
0.784008 |
![{[(p-Chlorophenyl)carbamoyl]methyl}dimethyl[(5,6,7,8-tetrahydro-2-naphthyl)methyl]ammoniun chloride](/api/spectrum/2gSY1qo8f0h/structure.png?h=300&w=458 "{[(p-Chlorophenyl)carbamoyl]methyl}dimethyl[(5,6,7,8-tetrahydro-2-naphthyl)methyl]ammoniun chloride")
