amine](/api/spectrum/BlPg4qtYYHo/structure.png?h=300&w=458 "[3-(1H-1,3-Benzodiazol-2-yl)propyl](thiophen-3-ylmethyl)amine")
| SpectraBase Compound ID | D4L8s1z2wfB |
|---|---|
| InChI | InChI=1S/C15H17N3S/c1-2-5-14-13(4-1)17-15(18-14)6-3-8-16-10-12-7-9-19-11-12/h1-2,4-5,7,9,11,16H,3,6,8,10H2,(H,17,18) |
| InChIKey | IWESTGAHFAXQTE-UHFFFAOYSA-N |
| Mol Weight | 271.38 g/mol |
| Molecular Formula | C15H17N3S |
| Exact Mass | 271.114319 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | BlPg4qtYYHo |
|---|---|
| Name | [3-(1H-1,3-Benzodiazol-2-yl)propyl](thiophen-3-ylmethyl)amine |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 271.114318733 u |
| Formula | C15H17N3S |
| InChI | InChI=1S/C15H17N3S/c1-2-5-14-13(4-1)17-15(18-14)6-3-8-16-10-12-7-9-19-11-12/h1-2,4-5,7,9,11,16H,3,6,8,10H2,(H,17,18) |
| InChIKey | IWESTGAHFAXQTE-UHFFFAOYSA-N |
| Molecular Weight | 271.382 g/mol |
| SMILES | C=1(C=CSC1)CNCCCC=1NC=2C=CC=CC2N1 |