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3-[ 4'-Acetamidomethyl-5'-benzyloxy-6'-methyl-3'-pyridyl]propyl methanesulfonate
SpectraBase Compound ID 6oUqjPEHHQo
InChI InChI=1S/C20H26N2O5S/c1-15-20(26-14-17-8-5-4-6-9-17)19(13-22-16(2)23)18(12-21-15)10-7-11-27-28(3,24)25/h4-6,8-9,12H,7,10-11,13-14H2,1-3H3,(H,22,23)
InChIKey QFCVRPZJWCYTJA-UHFFFAOYSA-N
Mol Weight 406.5 g/mol
Molecular Formula C20H26N2O5S
Exact Mass 406.156243 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8hVdgyJGumt
Name 3-[ 4'-Acetamidomethyl-5'-benzyloxy-6'-methyl-3'-pyridyl]propyl methanesulfonate
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Formula C20H26N2O5S
InChI InChI=1S/C20H26N2O5S/c1-15-20(26-14-17-8-5-4-6-9-17)19(13-22-16(2)23)18(12-21-15)10-7-11-27-28(3,24)25/h4-6,8-9,12H,7,10-11,13-14H2,1-3H3,(H,22,23)
InChIKey QFCVRPZJWCYTJA-UHFFFAOYSA-N
Molecular Weight 406.497 g/mol
SMILES N(C(=O)C)Cc1c(CCCOS(=O)(=O)C)cnc(C)c1OCc1ccccc1
SPLASH splash10-0006-9000000000-4f3d2f42c81ed7de2993
Source of Spectrum SB-46-71-31
Synonyms 3-[4-[(acetylamino)methyl]-5-(benzyloxy)-6-methyl-3-pyridinyl]propyl methanesulfonate 3-{5'-(Benzyloxy)-6'-methyl-4'-[(acetamido)methyl]-3'-pyridyl]propyl methane-sulfonate
Wiley ID 1372053