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5-Allyl-3a-methyl-1-phenyl-3,3a-dihydrothieno[3,4-c]quinolin-4(5H)-one
SpectraBase Compound ID 7KKfhnyQydi
InChI InChI=1S/C21H19NOS/c1-3-13-22-17-12-8-7-11-16(17)18-19(15-9-5-4-6-10-15)24-14-21(18,2)20(22)23/h3-12H,1,13-14H2,2H3
InChIKey VAFQCVYVSHKDEQ-UHFFFAOYSA-N
Mol Weight 333.45 g/mol
Molecular Formula C21H19NOS
Exact Mass 333.118735 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DDUoRgC7Gd2
Name 5-Allyl-3a-methyl-1-phenyl-3,3a-dihydrothieno[3,4-c]quinolin-4(5H)-one
Appearance Yellow solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H19NOS
InChI InChI=1S/C21H19NOS/c1-3-13-22-17-12-8-7-11-16(17)18-19(15-9-5-4-6-10-15)24-14-21(18,2)20(22)23/h3-12H,1,13-14H2,2H3
InChIKey VAFQCVYVSHKDEQ-UHFFFAOYSA-N
Instrument Name LRMS
Ionization Type EI
Literature Reference DOI 10.1002/adsc.201900621
Molecular Weight 333.449 g/mol
SMILES c1cc2c(cc1)N(C(C1(CSC(=C21)c1ccccc1)C)=O)CC=C
SPLASH splash10-0159-0019000000-60ab8607bf3e6cf5c4bc
Source of Spectrum ASC-361-SM13-3u
Wiley ID 1835387