| SpectraBase Spectrum ID |
FkQc6eo2Xkm |
| Name |
4-Butoxy-4-methoxy-2-phenylthiobutanenitrile |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C15H21NO2S |
| InChI |
InChI=1S/C15H21NO2S/c1-3-4-10-18-15(17-2)11-14(12-16)19-13-8-6-5-7-9-13/h5-9,14-15H,3-4,10-11H2,1-2H3 |
| InChIKey |
XERVMMLFKBAZOZ-UHFFFAOYSA-N |
| Molecular Weight |
279.398 g/mol |
| SMILES |
C(#N)C(CC(OC)OCCCC)Sc1ccccc1 |
| SPLASH |
splash10-03di-9000000000-38602b8f3774233715a0 |
| Source of Spectrum |
QA-41-809-11 |
| Synonyms |
4-butoxy-4-methoxy-2-(phenylsulfanyl)butanenitrile |
| Wiley ID |
861882 |
