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Me-o-CGMA
SpectraBase Compound ID 64lKNfVVDeO
InChI InChI=1S/C16H23NO5S/c1-11-6-4-5-7-15(11)22-8-13(19)9-23-10-14(16(20)21-3)17-12(2)18/h4-7,13-14,19H,8-10H2,1-3H3,(H,17,18)
InChIKey KCOFLTPKJUWWTP-UHFFFAOYSA-N
Mol Weight 341.42 g/mol
Molecular Formula C16H23NO5S
Exact Mass 341.129694 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4I4KeAGgrPE
Name Me-o-CGMA
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H23NO5S
InChI InChI=1S/C16H23NO5S/c1-11-6-4-5-7-15(11)22-8-13(19)9-23-10-14(16(20)21-3)17-12(2)18/h4-7,13-14,19H,8-10H2,1-3H3,(H,17,18)
InChIKey KCOFLTPKJUWWTP-UHFFFAOYSA-N
Molecular Weight 341.422 g/mol
SMILES N(C(CSCC(COc1c(C)cccc1)O)C(=O)OC)C(=O)C
SPLASH splash10-00or-1940000000-bf1014fd651fbdfde08c
Source of Spectrum CRT-11-116-fig.3/D
Synonyms Mercapturic Acid Methyl Ester ortho-Cresyl Glycidyl Ether Methyl 7-(2'-methylphenoxy)-2-(acetylamino)-6-hydroxy-4-thiaheptanoate
Wiley ID 1709787