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3-[(1,3-benzothiazol-2-ylsulfanyl)acetyl]-3,8,8-trimethyl-2,7-dioxaspiro[4.4]nonane-1,6-dione
SpectraBase Compound ID ATavezaNhpt
InChI InChI=1S/C19H19NO5S2/c1-17(2)9-19(14(22)24-17)10-18(3,25-15(19)23)13(21)8-26-16-20-11-6-4-5-7-12(11)27-16/h4-7H,8-10H2,1-3H3
InChIKey ILPZFZKVFAQLTN-UHFFFAOYSA-N
Mol Weight 405.48 g/mol
Molecular Formula C19H19NO5S2
Exact Mass 405.070465 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 4IFREsFwDfq
Name 3-[(1,3-benzothiazol-2-ylsulfanyl)acetyl]-3,8,8-trimethyl-2,7-dioxaspiro[4.4]nonane-1,6-dione
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C19H19NO5S2/c1-17(2)9-19(14(22)24-17)10-18(3,25-15(19)23)13(21)8-26-16-20-11-6-4-5-7-12(11)27-16/h4-7H,8-10H2,1-3H3
InChIKey ILPZFZKVFAQLTN-UHFFFAOYSA-N
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_14139
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent DMSO-d6
Source File Reference VendorID: D96974; Labnumber: AMIR2-5492; SBI_ID: SBI-014142
Temperature 306 °C