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methyl 6-chloro-1-(cyclohexylmethyl)-1H-indole-3-carboxylate
SpectraBase Compound ID y68z711HbL
InChI InChI=1S/C17H20ClNO2/c1-21-17(20)15-11-19(10-12-5-3-2-4-6-12)16-9-13(18)7-8-14(15)16/h7-9,11-12H,2-6,10H2,1H3
InChIKey OSHUIVUPNHSJCB-UHFFFAOYSA-N
Mol Weight 305.81 g/mol
Molecular Formula C17H20ClNO2
Exact Mass 305.118257 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5Ynwj8uR9Si
Name Methyl 6-chloro-1-(cyclohexylmethyl)-1H-indole-3-carboxylate
Classification Chemical
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 305.118256586 u
Formula C17H20ClNO2
InChI InChI=1S/C17H20ClNO2/c1-21-17(20)15-11-19(10-12-5-3-2-4-6-12)16-9-13(18)7-8-14(15)16/h7-9,11-12H,2-6,10H2,1H3
InChIKey OSHUIVUPNHSJCB-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 305.805 g/mol
Nominal Mass 305 u
Quality 910
Retention Index 2292
SMILES C=12C(C(=CN2CC2CCCCC2)C(OC)=O)=CC=C(C1)Cl
SPLASH splash10-05fr-3983000000-126ed092160037691def
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms methyl 6-chloro-1-(cyclohexylmethyl)-1H-indole-3-carboxylate
Technique GC/MS
Wiley ID DD2024_034637