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(S,E)-2-[3-(3,4-Dimethoxyphenyl)allyl]-1-methyl-1,2,3,4-tetrahydroquinoline

View entire compound with spectra: 1 MS (GC)

(S,E)-2-[3-(3,4-Dimethoxyphenyl)allyl]-1-methyl-1,2,3,4-tetrahydroquinoline
SpectraBase Compound ID 1I7q2uCpc0V
InChI InChI=1S/C21H25NO2/c1-22-18(13-12-17-8-4-5-10-19(17)22)9-6-7-16-11-14-20(23-2)21(15-16)24-3/h4-8,10-11,14-15,18H,9,12-13H2,1-3H3/b7-6+/t18-/m1/s1
InChIKey GCWLXQIEBUQJBO-IPLHWJFFSA-N
Mol Weight 323.44 g/mol
Molecular Formula C21H25NO2
Exact Mass 323.188529 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ETaaWCIraTJ
Name (S,E)-2-[3-(3,4-Dimethoxyphenyl)allyl]-1-methyl-1,2,3,4-tetrahydroquinoline
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H25NO2
InChI InChI=1S/C21H25NO2/c1-22-18(13-12-17-8-4-5-10-19(17)22)9-6-7-16-11-14-20(23-2)21(15-16)24-3/h4-8,10-11,14-15,18H,9,12-13H2,1-3H3/b7-6+/t18-/m1/s1
InChIKey GCWLXQIEBUQJBO-IPLHWJFFSA-N
Literature Reference DOI 10.1021/jo402759v
Molecular Weight 323.436 g/mol
SMILES c1ccc2N(C)[C@@](CCc2c1)(C\C=C\c1cc(c(cc1)OC)OC)[H]
SPLASH splash10-006t-0902000000-69adc6c9905a4112ec2b
Source of Spectrum J-79-1366-19
Synonyms (S,E)-2-(3-(3,4-dimethoxyphenyl)allyl)-1-methyl-1,2,3,4-tetrahydroquinoline
Wiley ID 1746082