SpectraBase Spectrum ID |
EjIWyWKrVVZ |
Name |
4-(1-HYDROXY-3-METHYL-4-METHYLSULFANYLBUT-3-ENYL)BENZONITRILE |
Copyright |
Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
Formula |
C13H15NOS |
InChI |
InChI=1S/C13H15NOS/c1-10(9-16-2)7-13(15)12-5-3-11(8-14)4-6-12/h3-6,9,13,15H,7H2,1-2H3/b10-9+ |
InChIKey |
UXMHQPXCHCMKGJ-MDZDMXLPSA-N |
Molecular Weight |
233.0871 |
SMILES |
OC(C\C(=C\SC)C)c1ccc(C#N)cc1 |
SPLASH |
splash10-0udi-8900000000-b22089db11affc1a423c |
Source of Spectrum |
Chemical Concepts, A Wiley Division, Weinheim, Germany |