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(3aR,5S)-5-(chloromethyl)-8-(hydroxymethyl)-3,3a,4,5-tetrahydropyrrolo[1,2-a]quinolin-1(2H)-one
SpectraBase Compound ID KA31oavfCGz
InChI InChI=1S/C14H16ClNO2/c15-7-10-6-11-2-4-14(18)16(11)13-5-9(8-17)1-3-12(10)13/h1,3,5,10-11,17H,2,4,6-8H2/t10-,11-/m1/s1
InChIKey SNFXHRFOMDZXTB-GHMZBOCLSA-N
Mol Weight 265.74 g/mol
Molecular Formula C14H16ClNO2
Exact Mass 265.086956 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KK1AvptdZr7
Name (3aR,5S)-5-(chloromethyl)-8-(hydroxymethyl)-3,3a,4,5-tetrahydropyrrolo[1,2-a]quinolin-1(2H)-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H16ClNO2
InChI InChI=1S/C14H16ClNO2/c15-7-10-6-11-2-4-14(18)16(11)13-5-9(8-17)1-3-12(10)13/h1,3,5,10-11,17H,2,4,6-8H2/t10-,11-/m1/s1
InChIKey SNFXHRFOMDZXTB-GHMZBOCLSA-N
Literature Reference DOI 10.1021/ol100220c
Molecular Weight 265.740 g/mol
SMILES OCc1cc2c(cc1)[C@@](CCl)(C[C@@]1(N2C(CC1)=O)[H])[H]
SPLASH splash10-014i-0190000000-3adf81daac3528075502
Source of Spectrum A1-12-1696/SM17-3l
Wiley ID 1751979