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GYWYASONLSQZBB-UHFFFAOYSA-N
SpectraBase Compound ID 17aE9tkAY4u
InChI InChI=1S/C7H14O/c1-4-5-6(2)7(3)8/h6H,4-5H2,1-3H3
InChIKey GYWYASONLSQZBB-UHFFFAOYSA-N
Mol Weight 114.19 g/mol
Molecular Formula C7H14O
Exact Mass 114.104465 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1TtvwFaGg6x
Name 2-Hexanone, 3-methyl-
CAS Registry Number 2550-21-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H14O
InChI InChI=1S/C7H14O/c1-4-5-6(2)7(3)8/h6H,4-5H2,1-3H3
InChIKey GYWYASONLSQZBB-UHFFFAOYSA-N
Molecular Weight 114.188 g/mol
SMILES CC(C(C)=O)CCC
SPLASH splash10-006x-9000000000-7a78398e9f7147c276cb
Source of Spectrum H-59-333-58
Synonyms 3-Methyl-2-hexanone CH3(CH2)2CH(CH3)COCH3 EINECS 219-846-9
Wiley ID 1124652