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2,7-bis[(2'-Iodoethoxycarbonyl)methyl]-N-methylphenothiazinhe
SpectraBase Compound ID AewCcFIGTP8
InChI InChI=1S/C21H21I2NO4S/c1-24-16-4-2-15(13-21(26)28-9-7-23)11-19(16)29-18-5-3-14(10-17(18)24)12-20(25)27-8-6-22/h2-5,10-11H,6-9,12-13H2,1H3
InChIKey RCOLGJVWYDQNRV-UHFFFAOYSA-N
Mol Weight 637.27 g/mol
Molecular Formula C21H21I2NO4S
Exact Mass 636.928069 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID J31isJUJIq8
Name 2,7-bis[(2'-Iodoethoxycarbonyl)methyl]-N-methylphenothiazinhe
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H21I2NO4S
InChI InChI=1S/C21H21I2NO4S/c1-24-16-4-2-15(13-21(26)28-9-7-23)11-19(16)29-18-5-3-14(10-17(18)24)12-20(25)27-8-6-22/h2-5,10-11H,6-9,12-13H2,1H3
InChIKey RCOLGJVWYDQNRV-UHFFFAOYSA-N
Molecular Weight 637.271 g/mol
SMILES c12N(c3c(Sc2ccc(c1)CC(=O)OCCI)cc(cc3)CC(=O)OCCI)C
SPLASH splash10-000i-0110109000-64041c8d35ecac83505f
Source of Spectrum K1-2001-3271-11
Wiley ID 814207