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Diethyl [{trans-2,3-dihydro-2-(1-oxopropyl)thiazolo[3,2-a]benzimidazol-3-yl}methyl]phosphonate
SpectraBase Compound ID 6zPQt8ushLc
InChI InChI=1S/C17H23N2O4PS/c1-4-15(20)16-14(11-24(21,22-5-2)23-6-3)19-13-10-8-7-9-12(13)18-17(19)25-16/h7-10,14,16H,4-6,11H2,1-3H3/t14-,16+/m1/s1
InChIKey NDPQNUSOHKHKBL-ZBFHGGJFSA-N
Mol Weight 382.41 g/mol
Molecular Formula C17H23N2O4PS
Exact Mass 382.111615 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DtC3rhn7uuv
Name Diethyl [{trans-2,3-dihydro-2-(1-oxopropyl)thiazolo[3,2-a]benzimidazol-3-yl}methyl]phosphonate
Alternate Name(s) Diethyl[(2S,3R)-2-propionyl-2,3-dihydro[1,3]thiazolo[3,2-a]benzimidazol-3-yl]methylphosphonate
CAS Registry Number 113250-25-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H23N2O4PS
InChI InChI=1S/C17H23N2O4PS/c1-4-15(20)16-14(11-24(21,22-5-2)23-6-3)19-13-10-8-7-9-12(13)18-17(19)25-16/h7-10,14,16H,4-6,11H2,1-3H3/t14-,16+/m1/s1
InChIKey NDPQNUSOHKHKBL-ZBFHGGJFSA-N
Molecular Weight 382.415 g/mol
SMILES c12[n]([C@](CP(=O)(OCC)OCC)([C@](S2)(C(=O)CC)[H])[H])c2ccccc2n1
SPLASH splash10-001i-0495000000-1bd9f162d73a497f0887
Source of Spectrum K-121-985-5
Wiley ID 1360403