Debug Info

object
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_id
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LcJViRU2Cr9
compoundID
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LcJViRU2Cr9
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name
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2-Benzyloxy-5-chloroaniline->N-p-tolylsulfonyl-H=acid
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2-Benzyloxy-5-chloroaniline->N-p-tolylsulfonyl-H=acid
SpectraBase Compound ID LcJViRU2Cr9
InChI InChI=1S/C30H24ClN3O10S3.2Na/c1-18-7-10-22(11-8-18)45(36,37)34-26-16-23(46(38,39)40)13-20-14-27(47(41,42)43)29(30(35)28(20)26)33-32-25-15-21(9-12-24(25)31)44-17-19-5-3-2-4-6-19;;/h2-16,34-35H,17H2,1H3,(H,38,39,40)(H,41,42,43);;/q;2*+1/p-2/b33-32+;;
InChIKey VSRGEXXHKIOOAO-BZAYTVMESA-L
Mol Weight 762.12953856 g/mol
Molecular Formula C30H22ClN3Na2O10S3
Exact Mass 760.995124 g/mol
Parent InChIKey FXSTUACWILFKSB-ULIFNZDWSA-L
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