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RTI-111 A (-Cl) I
SpectraBase Compound ID e0RsiPyVbS
InChI InChI=1S/C16H20ClNO2/c1-18-12-7-8-14(18)15(16(19)20-2)13(9-12)10-3-5-11(17)6-4-10/h3-6,12-15H,7-9H2,1-2H3/t12-,13-,14+,15-/m0/s1
InChIKey ZEOHVQFWFVMPGM-XQLPTFJDSA-N
Mol Weight 293.79 g/mol
Molecular Formula C16H20ClNO2
Exact Mass 293.118257 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GVeBgsDaFii
Name RTI-111 A (-Cl) I
Classification Designer drug artifact
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 293.118256586 u
Formula C16H20ClNO2
InChI InChI=1S/C16H20ClNO2/c1-18-12-7-8-14(18)15(16(19)20-2)13(9-12)10-3-5-11(17)6-4-10/h3-6,12-15H,7-9H2,1-2H3/t12-,13-,14+,15-/m0/s1
InChIKey ZEOHVQFWFVMPGM-XQLPTFJDSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 293.794 g/mol
Nominal Mass 293 u
Quality 996
Retention Index 2212
SMILES [C@]1([C@@]([C@@]2(N([C@](C1)(CC2)[H])C)[H])(C(OC)=O)[H])(C=1C=CC(=CC1)Cl)[H]
SPLASH splash10-001i-9210000000-5d2acbdc7184ba6708df
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms Dichloropane-A (-Cl) I Methyl 3-(4-chlorophenyl)-8-methyl-8-azabicyclo[3.2.1]octane-2-carboxylate
Technique GC/MS
Wiley ID DD2024_024762