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1H,3H-Pyrrolo[1,2-c]oxazol-1-one, 3-(1,1-dimethylethyl)tetrahydro-7a-phenyl-, (3R-cis)-
SpectraBase Compound ID 8aRJC7Je2pQ
InChI InChI=1S/C16H21NO2/c1-15(2,3)13-17-11-7-10-16(17,14(18)19-13)12-8-5-4-6-9-12/h4-6,8-9,13H,7,10-11H2,1-3H3/t13-,16-/m1/s1
InChIKey UVAXSYUJLWCEPM-CZUORRHYSA-N
Mol Weight 259.35 g/mol
Molecular Formula C16H21NO2
Exact Mass 259.157229 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KWkH6NI3Il9
Name 1H,3H-Pyrrolo[1,2-c]oxazol-1-one, 3-(1,1-dimethylethyl)tetrahydro-7a-phenyl-, (3R-cis)-
CAS Registry Number 86046-16-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H21NO2
InChI InChI=1S/C16H21NO2/c1-15(2,3)13-17-11-7-10-16(17,14(18)19-13)12-8-5-4-6-9-12/h4-6,8-9,13H,7,10-11H2,1-3H3/t13-,16-/m1/s1
InChIKey UVAXSYUJLWCEPM-CZUORRHYSA-N
Molecular Weight 259.349 g/mol
SMILES [C@@]1(N2[C@@](C(O1)=O)(c1ccccc1)CCC2)(C(C)(C)C)[H]
SPLASH splash10-00di-0900000000-8b36ea673530bb2f6d59
Source of Spectrum C-105-5395-0
Synonyms (2R,5R)-2-tert-butyl-5-phenyl-1-aza-3-oxabicyclo[3.3.0]octan-4-one (3R,7aR)-3-tert-butyl-7a-phenyltetrahydro-1H-pyrrolo[1,2-c][1,3]oxazol-1-one
Wiley ID 1262838