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[4,4-DIMETHYL-5-(2,3,3-TRIMETHYL-5-METHYLSULFANYL-3,4-DIHYDRO-2H-PYRROL-2-YLMETHYLENE)PYRROLIDIN-2-YLIDENE]HIOACETIC ACID, S-tert-BUTYL ESTER
SpectraBase Compound ID BM0hqOnHjcL
InChI InChI=1S/C21H36N2OS2/c1-18(2,3)26-17(24)10-14-11-19(4,5)15(22-14)12-21(8)20(6,7)13-16(23-21)25-9/h10,15,22H,11-13H2,1-9H3/b14-10+
InChIKey ZHMZURLKBDSGPF-GXDHUFHOSA-N
Mol Weight 396.7 g/mol
Molecular Formula C21H36N2OS2
Exact Mass 396.226906 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DF095tjI8Vk
Name [4,4-DIMETHYL-5-(2,3,3-TRIMETHYL-5-METHYLSULFANYL-3,4-DIHYDRO-2H-PYRROL-2-YLMETHYLENE)PYRROLIDIN-2-YLIDENE]HIOACETIC ACID, S-tert-BUTYL ESTER
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C21H34N2OS2
InChI InChI=1S/C21H36N2OS2/c1-18(2,3)26-17(24)10-14-11-19(4,5)15(22-14)12-21(8)20(6,7)13-16(23-21)25-9/h10,15,22H,11-13H2,1-9H3/b14-10+
InChIKey ZHMZURLKBDSGPF-GXDHUFHOSA-N
Molecular Weight 396.2261
SMILES N1C(C(C\C1=C\C(SC(C)(C)C)=O)(C)C)CC1(C)C(C)(C)CC(SC)=N1
SPLASH splash10-0a4i-8769000000-1382151230585e400c7e
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany