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Diethyl [(trans-2-acetyl-2,3-dihydrothiazolo[3,2-a]benzimidazol-3-yl)methyl]phosphonate
SpectraBase Compound ID 1haJF2YSa9n
InChI InChI=1S/C16H21N2O4PS/c1-4-21-23(20,22-5-2)10-14-15(11(3)19)24-16-17-12-8-6-7-9-13(12)18(14)16/h6-9,14-15H,4-5,10H2,1-3H3/t14-,15-/m1/s1
InChIKey SBUJNLOXRRZDSZ-HUUCEWRRSA-N
Mol Weight 368.39 g/mol
Molecular Formula C16H21N2O4PS
Exact Mass 368.095965 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JWgOAssUFH6
Name Diethyl [(trans-2-acetyl-2,3-dihydrothiazolo[3,2-a]benzimidazol-3-yl)methyl]phosphonate
CAS Registry Number 113250-07-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H21N2O4PS
InChI InChI=1S/C16H21N2O4PS/c1-4-21-23(20,22-5-2)10-14-15(11(3)19)24-16-17-12-8-6-7-9-13(12)18(14)16/h6-9,14-15H,4-5,10H2,1-3H3/t14-,15-/m1/s1
InChIKey SBUJNLOXRRZDSZ-HUUCEWRRSA-N
Molecular Weight 368.388 g/mol
SMILES c12[n]([C@](CP(=O)(OCC)OCC)([C@](S2)(C(=O)C)[H])[H])c2ccccc2n1
SPLASH splash10-014i-0091000000-cb770dae9b2534620cdb
Source of Spectrum K-121-985-5
Synonyms Diethyl[(2S,3R)-2-acetyl-2,3-dihydro[1,3]thiazolo[3,2-a]benzimidazol-3-yl]methylphosphonate
Wiley ID 1352821