| SpectraBase Spectrum ID |
5cIBbBqe7QT |
| Name |
4-Ethoxy-2-phenylthiopentanenitrile |
| Alternate Name(s) |
4-Ethoxy-2-phenylthiopentanenitrile isomer
4-ethoxy-2-(phenylsulfanyl)pentanenitrile |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C13H17NOS |
| InChI |
InChI=1S/C13H17NOS/c1-3-15-11(2)9-13(10-14)16-12-7-5-4-6-8-12/h4-8,11,13H,3,9H2,1-2H3 |
| InChIKey |
IUWXULZPQSBCBJ-UHFFFAOYSA-N |
| Molecular Weight |
235.345 g/mol |
| SMILES |
C(C(CC(C)OCC)Sc1ccccc1)#N |
| SPLASH |
splash10-000i-0920000000-8457f6cda2c6b9268343 |
| Source of Spectrum |
QA-41-808-9 |
| Wiley ID |
861885 |
