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4,5-dihydro-1-piperonyl-6(3aH)-indolinone

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4,5-dihydro-1-piperonyl-6(3aH)-indolinone
SpectraBase Compound ID KGrsQWqgZT2
InChI InChI=1S/C16H17NO3/c18-13-3-2-12-5-6-17(14(12)8-13)9-11-1-4-15-16(7-11)20-10-19-15/h1,4,7-8,12H,2-3,5-6,9-10H2
InChIKey SAOJKTSRKSGJMD-UHFFFAOYSA-N
Mol Weight 271.32 g/mol
Molecular Formula C16H17NO3
Exact Mass 271.120843 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID H9RljpyxuSl
Name 1-(3,4-Methylenedioxybenzyl)-1,2,3,3a,4,5-hexahydro-6H-indol-6-one
Alternate Name(s) 1-(1,3-benzodioxol-5-ylmethyl)-1,2,3,3a,4,5-hexahydro-6H-indol-6-one 1-(1,3-benzodioxol-5-ylmethyl)-3,3a,4,5-tetrahydro-2H-indol-6-one
CAS Registry Number 65673-77-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H17NO3
InChI InChI=1S/C16H17NO3/c18-13-3-2-12-5-6-17(14(12)8-13)9-11-1-4-15-16(7-11)20-10-19-15/h1,4,7-8,12H,2-3,5-6,9-10H2
InChIKey SAOJKTSRKSGJMD-UHFFFAOYSA-N
Molecular Weight 271.316 g/mol
SMILES C=12N(Cc3cc4OCOc4cc3)CCC2CCC(C1)=O
SPLASH splash10-00dr-0390000000-114f08f799aecf1b0cd5
Source of Spectrum J-44-1240-0
Wiley ID 1275335