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5-(3-Indolylacetyl)aminomethyl-2-cyclohexenone
SpectraBase Compound ID 1twbVGi6Rfd
InChI InChI=1S/C17H18N2O2/c20-14-5-3-4-12(8-14)10-19-17(21)9-13-11-18-16-7-2-1-6-15(13)16/h1-3,5-7,11-12,18H,4,8-10H2,(H,19,21)
InChIKey XSGHCPQVRXNSFY-UHFFFAOYSA-N
Mol Weight 282.34 g/mol
Molecular Formula C17H18N2O2
Exact Mass 282.136828 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GI4yuLZuNhL
Name 5-(3-Indolylacetyl)aminomethyl-2-cyclohexenone
Alternate Name(s) 2-(1H-indol-3-yl)-N-[(5-oxo-3-cyclohexen-1-yl)methyl]acetamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H18N2O2
InChI InChI=1S/C17H18N2O2/c20-14-5-3-4-12(8-14)10-19-17(21)9-13-11-18-16-7-2-1-6-15(13)16/h1-3,5-7,11-12,18H,4,8-10H2,(H,19,21)
InChIKey XSGHCPQVRXNSFY-UHFFFAOYSA-N
Molecular Weight 282.343 g/mol
SMILES [nH]1c2c(c(CC(NCC3CC(=O)C=CC3)=O)c1)cccc2
SPLASH splash10-001i-0910000000-b8f5013611a2cac00a73
Source of Spectrum H1-38-2460-6
Wiley ID 756732