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4,4-Dimethyl-1-pentyn-3-one
SpectraBase Compound ID CxXo3NZWydV
InChI InChI=1S/C7H10O/c1-5-6(8)7(2,3)4/h1H,2-4H3
InChIKey XRWYQSOYUZOEQH-UHFFFAOYSA-N
Mol Weight 110.16 g/mol
Molecular Formula C7H10O
Exact Mass 110.073165 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3NIC506ghDY
Name 4,4-Dimethyl-1-pentyn-3-one
CAS Registry Number 5891-25-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H10O
InChI InChI=1S/C7H10O/c1-5-6(8)7(2,3)4/h1H,2-4H3
InChIKey XRWYQSOYUZOEQH-UHFFFAOYSA-N
Molecular Weight 110.156 g/mol
SMILES C(C(C(C)(C)C)=O)#C
SPLASH splash10-0a4i-9000000000-bf6adcaccaea499a04a1
Source of Spectrum O-15-90-0
Synonyms 4,4-Dimethyl-1-pentyne-3-one 4,4-Dimethylpent-1-yn-3-one Pent-4-yn-3-one, 2,2-dimethyl-
Wiley ID 1122424