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2-Propyn-1-one, 1-(2,6-dimethylphenyl)-
SpectraBase Compound ID HIIr8DDPYKR
InChI InChI=1S/C11H10O/c1-4-10(12)11-8(2)6-5-7-9(11)3/h1,5-7H,2-3H3
InChIKey LFHDZBWVAYSZGD-UHFFFAOYSA-N
Mol Weight 158.2 g/mol
Molecular Formula C11H10O
Exact Mass 158.073165 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7SSWhAZJGU4
Name 2-Propyn-1-one, 1-(2,6-dimethylphenyl)-
CAS Registry Number 72839-13-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H10O
InChI InChI=1S/C11H10O/c1-4-10(12)11-8(2)6-5-7-9(11)3/h1,5-7H,2-3H3
InChIKey LFHDZBWVAYSZGD-UHFFFAOYSA-N
Molecular Weight 158.200 g/mol
SMILES C(C(c1c(cccc1C)C)=O)#C
SPLASH splash10-00or-1900000000-60f8c02012e86b52d944
Source of Spectrum H-69-572-11
Synonyms 1-(2,6-Dimethylphenyl)-2-propyn-1-one
Wiley ID 1155859