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Me-NACS
SpectraBase Compound ID 42EHy7FEXjf
InChI InChI=1S/C13H17NO4/c1-9-6-4-5-7-12(9)18-8-11(13(16)17-3)14-10(2)15/h4-7,11H,8H2,1-3H3,(H,14,15)/t11-/m0/s1
InChIKey AEYDMRQMXJJWTG-NSHDSACASA-N
Mol Weight 251.28 g/mol
Molecular Formula C13H17NO4
Exact Mass 251.115758 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5GYchAla0yc
Name Me-NACS
Alternate Name(s) Methyl 2-(N-acetylamino)-3-(2'-methylphenoxy)-propanoate N-Acetyl-O-(o-cresyl)-serine Methyl Ester
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Formula C13H17NO4
InChI InChI=1S/C13H17NO4/c1-9-6-4-5-7-12(9)18-8-11(13(16)17-3)14-10(2)15/h4-7,11H,8H2,1-3H3,(H,14,15)/t11-/m0/s1
InChIKey AEYDMRQMXJJWTG-NSHDSACASA-N
Molecular Weight 251.282 g/mol
SMILES N([C@](C(=O)OC)(COc1c(C)cccc1)[H])C(=O)C
SPLASH splash10-0006-4900000000-66d24bdd689de05c461d
Source of Spectrum CRT-11-116-fig.3/C
Wiley ID 1709788