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methyl {1,5-dimethyl-9-oxo-7-[(propylamino)carbothioyl]-3,7-diazabicyclo[3.3.1]non-3-yl}(oxo)acetate
SpectraBase Compound ID 8gIlJbUI0YW
InChI InChI=1S/C16H25N3O4S/c1-5-6-17-14(24)19-9-15(2)7-18(11(20)12(21)23-4)8-16(3,10-19)13(15)22/h5-10H2,1-4H3,(H,17,24)/t15-,16+
InChIKey FDTRTJWWKDMALN-IYBDPMFKSA-N
Mol Weight 355.45 g/mol
Molecular Formula C16H25N3O4S
Exact Mass 355.156577 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID LQDg0b2sP0P
Name methyl {1,5-dimethyl-9-oxo-7-[(propylamino)carbothioyl]-3,7-diazabicyclo[3.3.1]non-3-yl}(oxo)acetate
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 355.156577467 u
Formula C16H25N3O4S
InChI InChI=1S/C16H25N3O4S/c1-5-6-17-14(24)19-9-15(2)7-18(11(20)12(21)23-4)8-16(3,10-19)13(15)22/h5-10H2,1-4H3,(H,17,24)/t15-,16+
InChIKey FDTRTJWWKDMALN-IYBDPMFKSA-N
Molecular Weight 355.453 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_3689
Solvent DMSO-d6
Source Vendor ID: NMR/12308046