For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
1-ACETYL-3-METHYL-4-(METHYLSULFANYL)-2,3-DIHYDRO-1H-1,5-BENZODIAZEPINE
SpectraBase Compound ID 49gJqlaUoas
InChI InChI=1S/C13H16N2OS/c1-9-8-15(10(2)16)12-7-5-4-6-11(12)14-13(9)17-3/h4-7,9H,8H2,1-3H3
InChIKey YWKAGZVMLRWRIS-UHFFFAOYSA-N
Mol Weight 248.34 g/mol
Molecular Formula C13H16N2OS
Exact Mass 248.098334 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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 22sYmted6ZU
Name 1-ACETYL-3-METHYL-4-(METHYLSULFANYL)-2,3-DIHYDRO-1H-1,5-BENZODIAZEPINE
Compound Number 2C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H16N2OS
InChI InChI=1S/C13H16N2OS/c1-9-8-15(10(2)16)12-7-5-4-6-11(12)14-13(9)17-3/h4-7,9H,8H2,1-3H3
InChIKey YWKAGZVMLRWRIS-UHFFFAOYSA-N
Literature Reference Author L.KOSYCHOVA,A.KARALIUS,Z.STANIULYTE,R.A.SIRUTKAITIS,A.PALAIM A,A.LAURYNENAS,Z.ANU
Literature Reference Citation MOLECULES,20,5392(2015)
Literature Reference DOI 10.3390/molecules20045392
Molecular Weight 248.343 g/mol
Solvent CDCl3
Source File Reference UWPA3042