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1H-indole-3-ethanamine, N-[[1-(2,6-dimethylphenyl)-1H-tetrazol-5-yl]phenylmethyl]-2-methyl-
SpectraBase Compound ID 32Rujbs6qrG
InChI InChI=1S/C27H28N6/c1-18-10-9-11-19(2)26(18)33-27(30-31-32-33)25(21-12-5-4-6-13-21)28-17-16-22-20(3)29-24-15-8-7-14-23(22)24/h4-15,25,28-29H,16-17H2,1-3H3
InChIKey SMDVWBAYVKXVJY-UHFFFAOYSA-N
Mol Weight 436.56 g/mol
Molecular Formula C27H28N6
Exact Mass 436.237545 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1WHV4L2hxA
Name N-[[1-(2,6-dimethylphenyl)-1,2,3,4-tetrazol-5-yl]-phenyl-methyl]-2-(2-methyl-1H-indol-3-yl)ethanamine
Alternate Name(s) N-[[1-(2,6-dimethylphenyl)-5-tetrazolyl]-phenylmethyl]-2-(2-methyl-1H-indol-3-yl)ethanamine N-[[1-(2,6-dimethylphenyl)tetrazol-5-yl]-phenyl-methyl]-2-(2-methyl-1H-indol-3-yl)ethanamine [[1-(2,6-dimethylphenyl)tetrazol-5-yl]-phenyl-methyl]-[2-(2-methyl-1H-indol-3-yl)ethyl]amine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H28N6
InChI InChI=1S/C27H28N6/c1-18-10-9-11-19(2)26(18)33-27(30-31-32-33)25(21-12-5-4-6-13-21)28-17-16-22-20(3)29-24-15-8-7-14-23(22)24/h4-15,25,28-29H,16-17H2,1-3H3
InChIKey SMDVWBAYVKXVJY-UHFFFAOYSA-N
Molecular Weight 436.563 g/mol
SMILES N(C(c1[n](nnn1)-c1c(cccc1C)C)c1ccccc1)CCc1c([nH]c2c1cccc2)C
SPLASH splash10-052g-2900000000-7e0b26014838c4bb761d
Wiley ID 1466284