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N-(5-methyl-2-nitrobenzoyl)pyrrolidine-2-carboxaldehyde diethyl thioacetal
SpectraBase Compound ID 1GJiubmC08R
InChI InChI=1S/C17H24N2O3S2/c1-4-23-17(24-5-2)15-7-6-10-18(15)16(20)13-11-12(3)8-9-14(13)19(21)22/h8-9,11,15,17H,4-7,10H2,1-3H3
InChIKey QHJXLGLWRVXESG-UHFFFAOYSA-N
Mol Weight 368.51 g/mol
Molecular Formula C17H24N2O3S2
Exact Mass 368.122835 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DWTTNL9UsnY
Name N-(5-methyl-2-nitrobenzoyl)pyrrolidine-2-carboxaldehyde diethyl thioacetal
Alternate Name(s) 2-[bis(ethylsulfanyl)methyl]-1-(5-methyl-2-nitrobenzoyl)pyrrolidine
CAS Registry Number 105089-72-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H24N2O3S2
InChI InChI=1S/C17H24N2O3S2/c1-4-23-17(24-5-2)15-7-6-10-18(15)16(20)13-11-12(3)8-9-14(13)19(21)22/h8-9,11,15,17H,4-7,10H2,1-3H3
InChIKey QHJXLGLWRVXESG-UHFFFAOYSA-N
Molecular Weight 368.510 g/mol
SMILES c1(C(N2C(C(SCC)SCC)CCC2)=O)c(N(=O)=O)ccc(c1)C
SPLASH splash10-07ci-3932000000-fd56ddaa6ad9c2b5483f
Source of Spectrum J-52-95-5
Wiley ID 1352854