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acetamide, N-(3-cyano-5,6-dihydro-4H-cyclopenta[b]thien-2-yl)-2-(2-nitrophenoxy)-
SpectraBase Compound ID 3SOzJyJIYzX
InChI InChI=1S/C16H13N3O4S/c17-8-11-10-4-3-7-14(10)24-16(11)18-15(20)9-23-13-6-2-1-5-12(13)19(21)22/h1-2,5-6H,3-4,7,9H2,(H,18,20)
InChIKey PURHFQAJMLZTHF-UHFFFAOYSA-N
Mol Weight 343.36 g/mol
Molecular Formula C16H13N3O4S
Exact Mass 343.062677 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID DmXpaWwFw7G
Name acetamide, N-(3-cyano-5,6-dihydro-4H-cyclopenta[b]thien-2-yl)-2-(2-nitrophenoxy)-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 343.062677081 u
Formula C16H13N3O4S
InChI InChI=1S/C16H13N3O4S/c17-8-11-10-4-3-7-14(10)24-16(11)18-15(20)9-23-13-6-2-1-5-12(13)19(21)22/h1-2,5-6H,3-4,7,9H2,(H,18,20)
InChIKey PURHFQAJMLZTHF-UHFFFAOYSA-N
Molecular Weight 343.357 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_15466
Solvent DMSO-d6
Source Vendor ID: ZI/10020402; Lab Info: PNA; Lab Number: PNA-1990814