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2-Methyl-1-(m-methylbenzyl)-1-pyrrolinium perchlorate
SpectraBase Compound ID 2k5kRDH0wDC
InChI InChI=1S/C13H17N.ClHO4/c1-11-5-3-7-13(9-11)10-14-8-4-6-12(14)2;2-1(3,4)5/h3,5-7,9H,4,8,10H2,1-2H3;(H,2,3,4,5)
InChIKey CRRSTBYLHNGIHU-UHFFFAOYSA-N
Mol Weight 287.74 g/mol
Molecular Formula C13H18ClNO4
Exact Mass 287.092436 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9Az7Xzg30f0
Name 2-Methyl-1-(m-methylbenzyl)-1-pyrrolinium perchlorate
Alternate Name(s) 5-Methyl-1-(3-methylbenzyl)-2,3-dihydro-1H-pyrrolium perchlorate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H18ClNO4
InChI InChI=1S/C13H17N.ClHO4/c1-11-5-3-7-13(9-11)10-14-8-4-6-12(14)2;2-1(3,4)5/h3,5-7,9H,4,8,10H2,1-2H3;(H,2,3,4,5)
InChIKey CRRSTBYLHNGIHU-UHFFFAOYSA-N
Molecular Weight 287.743 g/mol
SMILES [NH+]1(CCC=C1C)Cc1cc(C)ccc1.[Cl]([O-])(=O)(=O)=O
SPLASH splash10-0a4i-1900000000-5ccc297ecdc86a6a5ee7
Source of Spectrum C-112-3605-63
Wiley ID 1290657