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5-Benzensulfonyl-5,6-dihydro-6-methoxycarbonylmethyl-7-methylphenanthridine
SpectraBase Compound ID 16sFm0pAadd
InChI InChI=1S/C23H21NO4S/c1-16-9-8-13-19-18-12-6-7-14-20(18)24(21(23(16)19)15-22(25)28-2)29(26,27)17-10-4-3-5-11-17/h3-14,21H,15H2,1-2H3
InChIKey NFVFHOXIIAMBGE-UHFFFAOYSA-N
Mol Weight 407.48 g/mol
Molecular Formula C23H21NO4S
Exact Mass 407.119129 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ESI3jQQnVys
Name 5-Benzensulfonyl-5,6-dihydro-6-methoxycarbonylmethyl-7-methylphenanthridine
Alternate Name(s) Methyl 2-(7-methyl-5-(phenylsulfonyl)-5,6-dihydrophenanthridin-6-yl)acetate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H21NO4S
InChI InChI=1S/C23H21NO4S/c1-16-9-8-13-19-18-12-6-7-14-20(18)24(21(23(16)19)15-22(25)28-2)29(26,27)17-10-4-3-5-11-17/h3-14,21H,15H2,1-2H3
InChIKey NFVFHOXIIAMBGE-UHFFFAOYSA-N
Literature Reference DOI 10.1002/adsc.200800512
Molecular Weight 407.484 g/mol
SMILES c1c2-c3cccc(C)c3C(CC(OC)=O)N(S(c3ccccc3)(=O)=O)c2ccc1
SPLASH splash10-0006-3912000000-5e634c1ebfe9e53bf767
Source of Spectrum ASC-350-2513/SM6-4i
Wiley ID 1765850