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N-(2-amino-5-methylbenzoyl)pyrrolidine-2-carboxaldehyde diethyl thioacetal
SpectraBase Compound ID EUe4XqzMUWy
InChI InChI=1S/C17H26N2OS2/c1-4-21-17(22-5-2)15-7-6-10-19(15)16(20)13-11-12(3)8-9-14(13)18/h8-9,11,15,17H,4-7,10,18H2,1-3H3
InChIKey JNIFGNTZGOSVRB-UHFFFAOYSA-N
Mol Weight 338.53 g/mol
Molecular Formula C17H26N2OS2
Exact Mass 338.148656 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KZ73lPi6b1F
Name N-(2-amino-5-methylbenzoyl)pyrrolidine-2-carboxaldehyde diethyl thioacetal
CAS Registry Number 105089-73-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H26N2OS2
InChI InChI=1S/C17H26N2OS2/c1-4-21-17(22-5-2)15-7-6-10-19(15)16(20)13-11-12(3)8-9-14(13)18/h8-9,11,15,17H,4-7,10,18H2,1-3H3
InChIKey JNIFGNTZGOSVRB-UHFFFAOYSA-N
Molecular Weight 338.528 g/mol
SMILES Nc1c(C(N2C(C(SCC)SCC)CCC2)=O)cc(cc1)C
SPLASH splash10-0f89-6961000000-fe0cb8c7d12885e3fb7e
Source of Spectrum J-52-95-6
Synonyms 2-({2-[bis(ethylsulfanyl)methyl]-1-pyrrolidinyl}carbonyl)-4-methylaniline 2-({2-[bis(ethylsulfanyl)methyl]-1-pyrrolidinyl}carbonyl)-4-methylphenylamine
Wiley ID 1333608