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exo-6-Chloro-3-(5-i-butoxy-2-phenyloxazolidin-3-yl)benzopyran-4-one
SpectraBase Compound ID GExkIkko0aU
InChI InChI=1S/C22H22ClNO4/c1-14(2)12-27-21-11-19(24(28-21)16-6-4-3-5-7-16)18-13-26-20-9-8-15(23)10-17(20)22(18)25/h3-10,13-14,19,21H,11-12H2,1-2H3
InChIKey URMBGKKUFKSBHZ-UHFFFAOYSA-N
Mol Weight 399.87 g/mol
Molecular Formula C22H22ClNO4
Exact Mass 399.123736 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5BfN1hBY4Yt
Name exo-6-Chloro-3-(5-i-butoxy-2-phenyloxazolidin-3-yl)benzopyran-4-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H22ClNO4
InChI InChI=1S/C22H22ClNO4/c1-14(2)12-27-21-11-19(24(28-21)16-6-4-3-5-7-16)18-13-26-20-9-8-15(23)10-17(20)22(18)25/h3-10,13-14,19,21H,11-12H2,1-2H3
InChIKey URMBGKKUFKSBHZ-UHFFFAOYSA-N
Molecular Weight 399.874 g/mol
SMILES C=1(C2N(OC(C2)OCC(C)C)c2ccccc2)C(c2cc(Cl)ccc2OC1)=O
SPLASH splash10-0a4r-0090000000-c960dcfbb72e70108b85
Source of Spectrum F-56-7824-13
Synonyms 6-Chloro-3-(5-isobutoxy-2-phenyl-3-isoxazolidinyl)-4H-chromen-4-one exo-6-Chloro-3-(5-i-butoxy-2-phenylisoxazolidin-3-yl)benzopyran-4-one exo-6-Chloro-3-(5-i-butoxy-2-phenyloxazol-3-yl)benzopyran-4-one
Wiley ID 858801