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4H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-4-one, 2-[(2-bromo-2-propenyl)thio]-3,5,6,7-tetrahydro-3-phenyl-
SpectraBase Compound ID 195BCBlA52J
InChI InChI=1S/C18H15BrN2OS2/c1-11(19)10-23-18-20-16-15(13-8-5-9-14(13)24-16)17(22)21(18)12-6-3-2-4-7-12/h2-4,6-7H,1,5,8-10H2
InChIKey WCEZORYGKWINDN-UHFFFAOYSA-N
Mol Weight 419.36 g/mol
Molecular Formula C18H15BrN2OS2
Exact Mass 417.980918 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID AxYbYOus3W7
Name 4H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-4-one, 2-[(2-bromo-2-propenyl)thio]-3,5,6,7-tetrahydro-3-phenyl-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 417.980918458 u
Formula C18H15BrN2OS2
InChI InChI=1S/C18H15BrN2OS2/c1-11(19)10-23-18-20-16-15(13-8-5-9-14(13)24-16)17(22)21(18)12-6-3-2-4-7-12/h2-4,6-7H,1,5,8-10H2
InChIKey WCEZORYGKWINDN-UHFFFAOYSA-N
Molecular Weight 419.355 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_10932
Solvent DMSO-d6
Source Vendor ID: NMR/9273788; Lab Info: ART; Lab Number: ART-ROS0490