| SpectraBase Spectrum ID |
ITkdEoxvMC7 |
| Name |
N-{4-[N-(3-Aminopropyl)-N-tolylamino]butyl}-o,o'-di(tert-butyl)-N,N'-(propan-1,3-diyl)bis[carbamate] |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
556.329456450 u |
| Formula |
C27H48N4O6S |
| InChI |
InChI=1S/C27H48N4O6S/c1-22-12-14-23(15-13-22)38(34,35)31(21-10-16-28)20-9-8-18-30(25(33)37-27(5,6)7)19-11-17-29-24(32)36-26(2,3)4/h12-15H,8-11,16-21,28H2,1-7H3,(H,29,32) |
| InChIKey |
SSKKJELNKGGVRT-UHFFFAOYSA-N |
| Molecular Weight |
556.763 g/mol |
| SMILES |
C(N(S(=O)(C1=CC=C(C=C1)C)=O)CCCN)CCCN(C(OC(C)(C)C)=O)CCCNC(=O)OC(C)(C)C |
![N-{4-[N-(3-Aminopropyl)-N-tolylamino]butyl}-o,o'-di(tert-butyl)-N,N'-(propan-1,3-diyl)bis[carbamate]](/api/spectrum/ITkdEoxvMC7/structure.png?h=300&w=458 "N-{4-[N-(3-Aminopropyl)-N-tolylamino]butyl}-o,o'-di(tert-butyl)-N,N'-(propan-1,3-diyl)bis[carbamate]")
