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Pyrano[4,3-b]indol-1(3H)-one, 4,5-dihydro-3,3-dimethyl-5-[(phenylmethoxy)methyl]-
SpectraBase Compound ID 7u1OXdt5Mor
InChI InChI=1S/C21H21NO3/c1-21(2)12-18-19(20(23)25-21)16-10-6-7-11-17(16)22(18)14-24-13-15-8-4-3-5-9-15/h3-11H,12-14H2,1-2H3
InChIKey JERSABUJQYFULZ-UHFFFAOYSA-N
Mol Weight 335.4 g/mol
Molecular Formula C21H21NO3
Exact Mass 335.152144 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Kz5P9klRILt
Name Pyrano[4,3-b]indol-1(3H)-one, 4,5-dihydro-3,3-dimethyl-5-[(phenylmethoxy)methyl]-
CAS Registry Number 122946-84-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H21NO3
InChI InChI=1S/C21H21NO3/c1-21(2)12-18-19(20(23)25-21)16-10-6-7-11-17(16)22(18)14-24-13-15-8-4-3-5-9-15/h3-11H,12-14H2,1-2H3
InChIKey JERSABUJQYFULZ-UHFFFAOYSA-N
Molecular Weight 335.403 g/mol
SMILES c12c([n](COCc3ccccc3)c3c1cccc3)CC(OC2=O)(C)C
SPLASH splash10-00gc-5976000000-ae80c4f5277ba0b0db10
Source of Spectrum J-54-4792-5
Synonyms 4-[(benzyloxy)methyl]-3,3-dimethyl-[2H]-1,4-dihydropyrano[4,3-b]indole 5-[(benzyloxy)methyl]-3,3-dimethyl-4,5-dihydropyrano[4,3-b]indol-1(3H)-one
Wiley ID 1331808