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(3R,7aR)-3-(Trichloromethyl)-7a-vinyltetrahydropyrrolo[1,2-c]oxazol-1(3H)-one
SpectraBase Compound ID 2oq3kmfoZ3j
InChI InChI=1S/C9H10Cl3NO2/c1-2-8-4-3-5-13(8)6(9(10,11)12)15-7(8)14/h2,6H,1,3-5H2/t6-,8+/m1/s1
InChIKey XVTSDRGGPSDRJX-SVRRBLITSA-N
Mol Weight 270.54 g/mol
Molecular Formula C9H10Cl3NO2
Exact Mass 268.977712 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2tlGOHEQNQC
Name (3R,7aR)-3-(Trichloromethyl)-7a-vinyltetrahydropyrrolo[1,2-c]oxazol-1(3H)-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H10Cl3NO2
InChI InChI=1S/C9H10Cl3NO2/c1-2-8-4-3-5-13(8)6(9(10,11)12)15-7(8)14/h2,6H,1,3-5H2/t6-,8+/m1/s1
InChIKey XVTSDRGGPSDRJX-SVRRBLITSA-N
Instrument Name Finnigan MAT Incos 50
Ionization Type EI
Literature Reference DOI 10.1002/chem.201406493
Optical Rotation [a]D22 = 49.9 (c = 0.660, CHCl3)
Quality 133
SMILES [C@]1(OC([C@]2(N1CCC2)C=C)=O)(C(Cl)(Cl)Cl)[H]
SPLASH splash10-00dj-9600000000-ea0fe8fa6f96e022c12e
Source of Spectrum QE-21-SM8-11 (DOI: 10.1002/chem.201406493)
Wiley ID 1906591