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2,2-Dimethyl-3-heptanone
SpectraBase Compound ID 4Iw1wTkqU7Q
InChI InChI=1S/C9H18O/c1-5-6-7-8(10)9(2,3)4/h5-7H2,1-4H3
InChIKey ZLMHETMAEHQFHK-UHFFFAOYSA-N
Mol Weight 142.24 g/mol
Molecular Formula C9H18O
Exact Mass 142.135765 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FnP3w19sk8X
Name 3-HEPTANONE, 2,2-DIMETHYL-
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C9H18O
InChI InChI=1S/C9H18O/c1-5-6-7-8(10)9(2,3)4/h5-7H2,1-4H3
InChIKey ZLMHETMAEHQFHK-UHFFFAOYSA-N
Molecular Weight 142.1353
SMILES CC(C(CCCC)=O)(C)C
SPLASH splash10-0a4i-9000000000-900abb241cf146e52912
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany