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2H-Indole, 3,3a,4,5,6,7-hexahydro-2,2-dimethyl-7-(phenylmethylene)-, 1-oxide
SpectraBase Compound ID Aj7FSlEjzfR
InChI InChI=1S/C17H21NO/c1-17(2)12-15-10-6-9-14(16(15)18(17)19)11-13-7-4-3-5-8-13/h3-5,7-8,11,15H,6,9-10,12H2,1-2H3/b14-11+
InChIKey OHBNCTBMDLJHMG-SDNWHVSQSA-N
Mol Weight 255.36 g/mol
Molecular Formula C17H21NO
Exact Mass 255.162314 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KffIktBNG6r
Name 2H-Indole, 3,3a,4,5,6,7-hexahydro-2,2-dimethyl-7-(phenylmethylene)-, 1-oxide
CAS Registry Number 89718-66-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H21NO
InChI InChI=1S/C17H21NO/c1-17(2)12-15-10-6-9-14(16(15)18(17)19)11-13-7-4-3-5-8-13/h3-5,7-8,11,15H,6,9-10,12H2,1-2H3/b14-11+
InChIKey OHBNCTBMDLJHMG-SDNWHVSQSA-N
Molecular Weight 255.361 g/mol
SMILES C12=[N+](C(CC1CCC\C2=C\c1ccccc1)(C)C)[O-]
SPLASH splash10-0udi-0290000000-cfe041dfe21d275da892
Source of Spectrum B-37-584-0
Synonyms (7E)-7-benzylidene-2,2-dimethyl-3,3a,4,5,6,7-hexahydro-2H-indole 1-oxide 7-Benzylidene-2,2-dimethyl-3,3a,4,5,6,7-hexahydro-2H-indol-3a-ol 7-Benzylidene-2,2-dimethyl-3,3a,4,5,6,7-hexahydro-2H-indole 1-oxide
Wiley ID 1259020