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1H,3H-Pyrrolo[1,2-c]oxazol-1-one, 3-(1,1-dimethylethyl)tetrahydro-7a-(1-hydroxy-2-cyclohexen-1-yl)-, [3R-[3.alpha.,7a.alpha.(S*)]]-
SpectraBase Compound ID LgAePy7VFGn
InChI InChI=1S/C16H25NO3/c1-15(2,3)13-17-9-5-8-16(17,14(19)20-13)11-6-4-7-12(18)10-11/h11,13H,4-10H2,1-3H3/t11?,13-,16-/m1/s1
InChIKey GABFQLKSNLBYLD-ZUZSALNQSA-N
Mol Weight 279.38 g/mol
Molecular Formula C16H25NO3
Exact Mass 279.183444 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 30vR8J5fxxB
Name 1H,3H-Pyrrolo[1,2-c]oxazol-1-one, 3-(1,1-dimethylethyl)tetrahydro-7a-(1-hydroxy-2-cyclohexen-1-yl)-, [3R-[3.alpha.,7a.alpha.(S*)]]-
CAS Registry Number 86046-25-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H25NO3
InChI InChI=1S/C16H25NO3/c1-15(2,3)13-17-9-5-8-16(17,14(19)20-13)11-6-4-7-12(18)10-11/h11,13H,4-10H2,1-3H3/t11?,13-,16-/m1/s1
InChIKey GABFQLKSNLBYLD-ZUZSALNQSA-N
Molecular Weight 279.380 g/mol
SMILES [C@@]12(N([C@](OC2=O)(C(C)(C)C)[H])CCC1)C1CC(=O)CCC1
SPLASH splash10-0159-4910000000-95b3e80950470f2a9135
Source of Spectrum C-105-5396-0
Synonyms (2R,5R)-2-tert-butyl-5-(3'-oxocyclohexyl)-1-aza-3-oxabicyclo[3.3.0]octan-4-one (3R,7aR)-3-tert-butyl-7a-(3-oxocyclohexyl)tetrahydro-1H-pyrrolo[1,2-c][1,3]oxazol-1-one
Wiley ID 1283053