| SpectraBase Spectrum ID |
2MXgK4WZzy3 |
| Name |
2-Methylthio-1-piperidinecarboxy-m-anisidide |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
264.129634445 u |
| Formula |
C14H20N2OS |
| InChI |
InChI=1S/C14H20N2OS/c1-11-6-3-4-9-16(11)14(18)15-12-7-5-8-13(10-12)17-2/h5,7-8,10-11H,3-4,6,9H2,1-2H3,(H,15,18) |
| InChIKey |
RALGOPOOXZCBTQ-UHFFFAOYSA-N |
| Molecular Weight |
264.387 g/mol |
| SMILES |
N(C(N1CCCCC1C)=S)C=1C=C(C=CC1)OC |
| Spectrum/Structure Validation Score (Raman) |
0.864321 |
