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(3S,3aR)-1-(4-Bromo-phenyl)-3-chloro-3,3a-dihydro-1H-cyclohepta[b]pyrrol-2-one
SpectraBase Compound ID AJH66TaPbnk
InChI InChI=1S/C15H11BrClNO/c16-10-6-8-11(9-7-10)18-13-5-3-1-2-4-12(13)14(17)15(18)19/h1-9,12,14H/t12-,14+/m1/s1
InChIKey MQNJFMNXPVXAEY-OCCSQVGLSA-N
Mol Weight 336.62 g/mol
Molecular Formula C15H11BrClNO
Exact Mass 334.971255 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EDiWDUXUhfQ
Name (3S,3aR)-1-(4-Bromo-phenyl)-3-chloro-3,3a-dihydro-1H-cyclohepta[b]pyrrol-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H11BrClNO
InChI InChI=1S/C15H11BrClNO/c16-10-6-8-11(9-7-10)18-13-5-3-1-2-4-12(13)14(17)15(18)19/h1-9,12,14H/t12-,14+/m1/s1
InChIKey MQNJFMNXPVXAEY-OCCSQVGLSA-N
Molecular Weight 336.616 g/mol
SMILES C1(N(C=2[C@]([C@@]1(Cl)[H])(C=CC=CC2)[H])c1ccc(cc1)Br)=O
SPLASH splash10-0udi-0309000000-f05d7f43e43e002a6875
Source of Spectrum AJ-65-815-6
Synonyms (3S,3aR)-1-(4-bromophenyl)-3-chloro-3,3a-dihydrocyclohepta[b]pyrrol-2(1H)-one 3-Chloro-1-N-(p-bromophenyl)-azaazulen-2(1H)-one
Wiley ID 771184