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1-Pentanone, 1-(1H-imidazol-2-yl)-
SpectraBase Compound ID BadbLeDaeRe
InChI InChI=1S/C8H12N2O/c1-2-3-4-7(11)8-9-5-6-10-8/h5-6H,2-4H2,1H3,(H,9,10)
InChIKey NVLNYDCUOMCCOW-UHFFFAOYSA-N
Mol Weight 152.2 g/mol
Molecular Formula C8H12N2O
Exact Mass 152.094963 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1KR9fxDgatR
Name 1-Pentanone, 1-(1H-imidazol-2-yl)-
Alternate Name(s) 1-(1H-Imidazol-2-yl)-1-pentanone 1-(1H-imidazol-2-yl)pentan-1-one 2-Valerylimidazole
CAS Registry Number 69393-14-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H12N2O
InChI InChI=1S/C8H12N2O/c1-2-3-4-7(11)8-9-5-6-10-8/h5-6H,2-4H2,1H3,(H,9,10)
InChIKey NVLNYDCUOMCCOW-UHFFFAOYSA-N
Molecular Weight 152.197 g/mol
SMILES [nH]1ccnc1C(=O)CCCC
SPLASH splash10-0i0s-9600000000-cd933c89154277e44374
Source of Spectrum H-61-2828-0
Wiley ID 1148835