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1H,3H-Pyrrolo[1,2-c]oxazol-3-one, 7-(benzoyloxy)tetrahydro-1-propyl-, (1.alpha.,7.beta.,7a.alpha.)-
SpectraBase Compound ID 3IyybNjxrOg
InChI InChI=1S/C16H19NO4/c1-2-6-12-14-13(9-10-17(14)16(19)21-12)20-15(18)11-7-4-3-5-8-11/h3-5,7-8,12-14H,2,6,9-10H2,1H3/t12-,13+,14+/m1/s1
InChIKey AMAIYOLWGOHUNK-RDBSUJKOSA-N
Mol Weight 289.33 g/mol
Molecular Formula C16H19NO4
Exact Mass 289.131408 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JI8bWCUx1Zd
Name 1H,3H-Pyrrolo[1,2-c]oxazol-3-one, 7-(benzoyloxy)tetrahydro-1-propyl-, (1.alpha.,7.beta.,7a.alpha.)-
CAS Registry Number 117755-07-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H19NO4
InChI InChI=1S/C16H19NO4/c1-2-6-12-14-13(9-10-17(14)16(19)21-12)20-15(18)11-7-4-3-5-8-11/h3-5,7-8,12-14H,2,6,9-10H2,1H3/t12-,13+,14+/m1/s1
InChIKey AMAIYOLWGOHUNK-RDBSUJKOSA-N
Molecular Weight 289.331 g/mol
SMILES C1(N2[C@@]([C@](O1)(CCC)[H])([C@@](OC(=O)c1ccccc1)(CC2)[H])[H])=O
SPLASH splash10-0159-0900000000-7d29c774ab24e5568a4f
Source of Spectrum J-53-5499-0
Synonyms (1R,7S,7aR)-3-oxo-1-propyltetrahydro-1H-pyrrolo[1,2-c][1,3]oxazol-7-yl benzoate 4-exo-propyl-6-endo-(benzoyloxy)-1-aza-3-oxabicyclo[3.3.0]octan-2-one
Wiley ID 1292649