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Diacetone alcohol
SpectraBase Compound ID EewLZs4mM4K
InChI InChI=1S/C6H12O2/c1-5(7)4-6(2,3)8/h8H,4H2,1-3H3
InChIKey SWXVUIWOUIDPGS-UHFFFAOYSA-N
Mol Weight 116.16 g/mol
Molecular Formula C6H12O2
Exact Mass 116.08373 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID K3Dzvf794iV
Name 4-Hydroxy-4-methylpentane-2-one
CAS Registry Number 123-42-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C6H12O2
InChI InChI=1S/C6H12O2/c1-5(7)4-6(2,3)8/h8H,4H2,1-3H3
InChIKey SWXVUIWOUIDPGS-UHFFFAOYSA-N
Molecular Weight 116.160 g/mol
SMILES OC(C)(CC(C)=O)C
SPLASH splash10-052f-9000000000-46c5e8e4eac095c4ac1b
Source of Spectrum AA-0-432-1
Synonyms 2-Pentanone, 4-hydroxy-4-methyl- Diacetone alcohol (CH3)2C(OH)CH2C(O)CH3 2-Hydroxy-2-methyl-4-pentanone 2-Methyl-2-pentanol-4-one 4-Hydroxy-2-keto-4-methylpentane 4-Hydroxy-4-methyl pentan-2-one 4-Hydroxy-4-methyl-2-pentanone 4-Hydroxy-4-methyl-pentan-2-on 4-Hydroxy-4-methylpentan-2-one 4-Hydroxy-4-methyl-pentan-2-one 4-Hydroxy-4-methylpentanone 4-Hydroxy-4-methylpentanone-2 4-Idrossi-4-metil-pentan-2-one 4-Methyl-2-pentanon-4-ol 4-Methyl-4-hydroxy-2-pentanone 4-Methyl-4-oxidanyl-pentan-2-one Acetonyldimethylcarbinol Diacetonalcohol Diacetonalcool Diacetonalkohol Diacetone Diacetone-alcool Diacetonyl alcohol Diketone alcohol Dimethyl acetonyl carbinol Pyranton Pyranton A Pyraton Tyranton AI3-00045 BRN 1740440 CASWELL NO. 280 CCRIS 6177 EINECS 204-626-7 EPA PESTICIDE CHEMICAL CODE 033901 HSDB 1152 NSC 9005 UN1148
Wiley ID 69747