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3a,4-trans-3a,6a-cis-3-(2,4-dichlorophenyl)-3a,5,6,6a-tetrahydro-4H-cyclopenta[d]isoxazole-4-ol
SpectraBase Compound ID 1c2vAkijHkA
InChI InChI=1S/C12H11Cl2NO2/c13-6-1-2-7(8(14)5-6)12-11-9(16)3-4-10(11)17-15-12/h1-2,5,9-11,16H,3-4H2/t9-,10+,11-/m0/s1
InChIKey KCYFZFHUGNAERR-AXFHLTTASA-N
Mol Weight 272.13 g/mol
Molecular Formula C12H11Cl2NO2
Exact Mass 271.016684 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID K2PoeWDATHc
Name 3a,4-trans-3a,6a-cis-3-(2,4-dichlorophenyl)-3a,5,6,6a-tetrahydro-4H-cyclopenta[d]isoxazole-4-ol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H11Cl2NO2
InChI InChI=1S/C12H11Cl2NO2/c13-6-1-2-7(8(14)5-6)12-11-9(16)3-4-10(11)17-15-12/h1-2,5,9-11,16H,3-4H2/t9-,10+,11-/m0/s1
InChIKey KCYFZFHUGNAERR-AXFHLTTASA-N
Molecular Weight 272.131 g/mol
SMILES O[C@@]1([C@@]2(C(=NO[C@@]2(CC1)[H])c1c(cc(cc1)Cl)Cl)[H])[H]
SPLASH splash10-03di-0090000000-63bb982ac5503b692780
Source of Spectrum QB-20-123-2
Synonyms (3aS,4S,6aR)-3-(2,4-dichlorophenyl)-4,5,6,6a-tetrahydro-3aH-cyclopenta[d]isoxazol-4-ol 3a,4-cis-3a,6a-cis-3-(2,4-dichlorophenyl)-3a,5,6,6a-tetrahydro-4H-cyclopenta[d]isoxazole-4-ol
Wiley ID 842189