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(3aR,7aS)-5-chloro-2-methyl-6-vinyl-3a,4,7,7a-tetrahydro-1H-isoindole-1,3(2H)-dione
SpectraBase Compound ID 19qT1PBR525
InChI InChI=1S/C11H12ClNO2/c1-3-6-4-7-8(5-9(6)12)11(15)13(2)10(7)14/h3,7-8H,1,4-5H2,2H3/t7-,8+/m0/s1
InChIKey PSIXACFXRYWUPZ-JGVFFNPUSA-N
Mol Weight 225.67 g/mol
Molecular Formula C11H12ClNO2
Exact Mass 225.055656 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2jCYp3ld577
Name (3aR,7aS)-5-chloro-2-methyl-6-vinyl-3a,4,7,7a-tetrahydro-1H-isoindole-1,3(2H)-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H12ClNO2
InChI InChI=1S/C11H12ClNO2/c1-3-6-4-7-8(5-9(6)12)11(15)13(2)10(7)14/h3,7-8H,1,4-5H2,2H3/t7-,8+/m0/s1
InChIKey PSIXACFXRYWUPZ-JGVFFNPUSA-N
Literature Reference DOI 10.1021/ol7021998
Molecular Weight 225.675 g/mol
SMILES C1(=C(Cl)C[C@@]2([C@@](C(N(C2=O)C)=O)(C1)[H])[H])C=C
SPLASH splash10-0a6r-0940000000-9e169dd240d89e359eb8
Source of Spectrum A1-9-4861/SMS15-16a
Wiley ID 1758756