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2-methyl-a-Pyrrolidinoisohexanophenone
SpectraBase Compound ID 5xkBwa4scN
InChI InChI=1S/C17H25NO/c1-13(2)12-16(18-10-6-7-11-18)17(19)15-9-5-4-8-14(15)3/h4-5,8-9,13,16H,6-7,10-12H2,1-3H3
InChIKey AOKOELDLOCWLOH-UHFFFAOYSA-N
Mol Weight 259.39 g/mol
Molecular Formula C17H25NO
Exact Mass 259.193614 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DS6KUJzCncQ
Name 2-methyl-a-Pyrrolidinoisohexanophenone
Catalog Number 37759
Lot Number 677572
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H25NO
InChI InChI=1S/C17H25NO/c1-13(2)12-16(18-10-6-7-11-18)17(19)15-9-5-4-8-14(15)3/h4-5,8-9,13,16H,6-7,10-12H2,1-3H3
InChIKey AOKOELDLOCWLOH-UHFFFAOYSA-N
Molecular Weight 259.393 g/mol
Purity >=98%
Quality 984
SMILES C1=CC=CC(=C1C)C(C(N1CCCC1)CC(C)C)=O
SPLASH splash10-0006-6900000000-82e2099923f79ef480ea
Source of Spectrum CAY-2024-2295-0
Synonyms 2-methyl-.alpha.-PiHP 4-methyl-2-(pyrrolidin-1-yl)-1-(o-tolyl)pentan-1-one 4-methyl-1-(2-methylphenyl)-2-(pyrrolidin-1-yl)pentan-1-one
Wiley ID 1890477