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5-(endo)-Chloro-2-(exo)-cyano-1-methyl-6-(exo)-(phenylselenyl)-7-oxabicyclo[2.2.1]hept-2-(endo)-yl acetate
SpectraBase Compound ID GGpR6FosOCt
InChI InChI=1S/C16H16ClNO3Se/c1-10(19)20-16(9-18)8-12-13(17)14(15(16,2)21-12)22-11-6-4-3-5-7-11/h3-7,12-14H,8H2,1-2H3/t12-,13?,14?,15-,16-/m1/s1
InChIKey ARUFKOVJWZCCQC-OPKDVZQQSA-N
Mol Weight 384.73 g/mol
Molecular Formula C16H16ClNO3Se
Exact Mass 384.998393 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID G7BdRHsgbXo
Name 5-(endo)-Chloro-2-(exo)-cyano-1-methyl-6-(exo)-(phenylselenyl)-7-oxabicyclo[2.2.1]hept-2-(endo)-yl acetate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H16ClNO3Se
InChI InChI=1S/C16H16ClNO3Se/c1-10(19)20-16(9-18)8-12-13(17)14(15(16,2)21-12)22-11-6-4-3-5-7-11/h3-7,12-14H,8H2,1-2H3/t12-,13?,14?,15-,16-/m1/s1
InChIKey ARUFKOVJWZCCQC-OPKDVZQQSA-N
Molecular Weight 384.733 g/mol
SMILES [C@@]12([C@@](C[C@@](O2)(C(C1[Se]c1ccccc1)Cl)[H])(C#N)OC(=O)C)C
SPLASH splash10-0f92-9200000000-2a2b78bb1428d5890ab9
Source of Spectrum H-76-2341-6
Synonyms 5-Chloro-2-cyano-1-methyl-6-(phenylselanyl)-7-oxabicyclo[2.2.1]hept-2-yl acetate
Wiley ID 1362086