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Diethyl [{trans-2,3-dihydro-2-(2-methyl-1-oxopropyl)thiazolo[3,2-a]benzimidazol-3-yl}methyl]phosphonate
SpectraBase Compound ID 2K7fJr1o5s5
InChI InChI=1S/C18H25N2O4PS/c1-5-23-25(22,24-6-2)11-15-17(16(21)12(3)4)26-18-19-13-9-7-8-10-14(13)20(15)18/h7-10,12,15,17H,5-6,11H2,1-4H3/t15-,17+/m1/s1
InChIKey UDCRZNJUAVUXGZ-WBVHZDCISA-N
Mol Weight 396.44 g/mol
Molecular Formula C18H25N2O4PS
Exact Mass 396.127265 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3pCfVxfC1hi
Name Diethyl [{trans-2,3-dihydro-2-(2-methyl-1-oxopropyl)thiazolo[3,2-a]benzimidazol-3-yl}methyl]phosphonate
CAS Registry Number 113250-26-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H25N2O4PS
InChI InChI=1S/C18H25N2O4PS/c1-5-23-25(22,24-6-2)11-15-17(16(21)12(3)4)26-18-19-13-9-7-8-10-14(13)20(15)18/h7-10,12,15,17H,5-6,11H2,1-4H3/t15-,17+/m1/s1
InChIKey UDCRZNJUAVUXGZ-WBVHZDCISA-N
Molecular Weight 396.442 g/mol
SMILES c12[n]([C@](CP(=O)(OCC)OCC)([C@](S2)(C(=O)C(C)C)[H])[H])c2ccccc2n1
SPLASH splash10-0002-0191000000-82b16bd3dae17b0cb6eb
Source of Spectrum K-121-985-5
Synonyms Diethyl[(2S,3R)-2-isobutyryl-2,3-dihydro[1,3]thiazolo[3,2-a]benzimidazol-3-yl]methylphosphonate
Wiley ID 1367298