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1-(2-Bromo-4,5-methylenedioxybenzyl)-3-(cyclohexylamino)-4,5,6-trihydro-2H-indol-2-one
SpectraBase Compound ID 37SNPauGMmj
InChI InChI=1S/C22H25BrN2O3/c23-17-11-20-19(27-13-28-20)10-14(17)12-25-18-9-5-4-8-16(18)21(22(25)26)24-15-6-2-1-3-7-15/h9-11,15,24H,1-8,12-13H2
InChIKey KBBBPZNJKYGJLC-UHFFFAOYSA-N
Mol Weight 445.36 g/mol
Molecular Formula C22H25BrN2O3
Exact Mass 444.104856 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8LD621M9Yqq
Name 1-(2-Bromo-4,5-methylenedioxybenzyl)-3-(cyclohexylamino)-4,5,6-trihydro-2H-indol-2-one
Alternate Name(s) 1-[(6-bromo-1,3-benzodioxol-5-yl)methyl]-3-(cyclohexylamino)-1,4,5,6-tetrahydro-2H-indol-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H25BrN2O3
InChI InChI=1S/C22H25BrN2O3/c23-17-11-20-19(27-13-28-20)10-14(17)12-25-18-9-5-4-8-16(18)21(22(25)26)24-15-6-2-1-3-7-15/h9-11,15,24H,1-8,12-13H2
InChIKey KBBBPZNJKYGJLC-UHFFFAOYSA-N
Molecular Weight 445.357 g/mol
SMILES N(C=1C(N(C=2C1CCCC2)Cc1c(cc2c(c1)OCO2)Br)=O)C1CCCCC1
SPLASH splash10-014i-0049200000-a35b850a07a2152e8d13
Source of Spectrum F-52-10575-7
Wiley ID 797919