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(3aR,5S)-8-chloro-5-(chloromethyl)-3,3a,4,5-tetrahydropyrrolo[1,2-a]quinolin-1(2H)-one
SpectraBase Compound ID NN3itwXDVd
InChI InChI=1S/C13H13Cl2NO/c14-7-8-5-10-2-4-13(17)16(10)12-6-9(15)1-3-11(8)12/h1,3,6,8,10H,2,4-5,7H2/t8-,10-/m1/s1
InChIKey LZBZPMQIVYMGCA-PSASIEDQSA-N
Mol Weight 270.16 g/mol
Molecular Formula C13H13Cl2NO
Exact Mass 269.037419 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Jh3ioH3CdNc
Name (3aR,5S)-8-chloro-5-(chloromethyl)-3,3a,4,5-tetrahydropyrrolo[1,2-a]quinolin-1(2H)-one
Alternate Name(s) (3aR,5S)-8-chloranyl-5-(chloromethyl)-3,3a,4,5-tetrahydro-2H-pyrrolo[1,2-a]quinolin-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H13Cl2NO
InChI InChI=1S/C13H13Cl2NO/c14-7-8-5-10-2-4-13(17)16(10)12-6-9(15)1-3-11(8)12/h1,3,6,8,10H,2,4-5,7H2/t8-,10-/m1/s1
InChIKey LZBZPMQIVYMGCA-PSASIEDQSA-N
Literature Reference DOI 10.1021/ol100220c
Molecular Weight 270.159 g/mol
SMILES c1cc2c(cc1Cl)N1[C@@](CCC1=O)([H])C[C@@]2(CCl)[H]
SPLASH splash10-00dr-2490000000-604d2e43143ebd5f700e
Source of Spectrum A1-12-1696/SM16-3i
Wiley ID 1751977