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(6R,7S,7aS)-6-acetyl-3,3-dimethyl-7-prop-2-enyl-1,6,7,7a-tetrahydropyrrolo[1,2-c]oxazol-5-one
SpectraBase Compound ID 7PZhXr4PNUw
InChI InChI=1S/C13H19NO3/c1-5-6-9-10-7-17-13(3,4)14(10)12(16)11(9)8(2)15/h5,9-11H,1,6-7H2,2-4H3/t9-,10-,11+/m1/s1
InChIKey KMFMNDHCKCJXSM-MXWKQRLJSA-N
Mol Weight 237.3 g/mol
Molecular Formula C13H19NO3
Exact Mass 237.136493 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DYJJHQoUirS
Name (6R,7S,7aS)-6-acetyl-3,3-dimethyl-7-prop-2-enyl-1,6,7,7a-tetrahydropyrrolo[1,2-c]oxazol-5-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H19NO3
InChI InChI=1S/C13H19NO3/c1-5-6-9-10-7-17-13(3,4)14(10)12(16)11(9)8(2)15/h5,9-11H,1,6-7H2,2-4H3/t9-,10-,11+/m1/s1
InChIKey KMFMNDHCKCJXSM-MXWKQRLJSA-N
Molecular Weight 237.299 g/mol
SMILES C1(N2[C@@]([C@]([C@@]1(C(=O)C)[H])(CC=C)[H])(COC2(C)C)[H])=O
SPLASH splash10-0076-9860000000-eeb5004200f6db29ae60
Source of Spectrum H1-50-974-6
Synonyms (6R,7S,7aS)-6-acetyl-3,3-dimethyl-7-prop-2-enyl-1,6,7,7a-tetrahydropyrrolo[1,2-c][1,3]oxazol-5-one (6R,7S,7aS)-6-acetyl-7-allyl-3,3-dimethyl-1,6,7,7a-tetrahydropyrrolo[1,2-c]oxazol-5-one (6R,7S,7aS)-6-ethanoyl-3,3-dimethyl-7-prop-2-enyl-1,6,7,7a-tetrahydropyrrolo[1,2-c][1,3]oxazol-5-one
Wiley ID 816846