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4-Methyl-5-heptyn-2-one, 7-methoxy-1,1,1-triphenyl-
SpectraBase Compound ID hHpruq14Gl
InChI InChI=1S/C27H26O2/c1-22(13-12-20-29-2)21-26(28)27(23-14-6-3-7-15-23,24-16-8-4-9-17-24)25-18-10-5-11-19-25/h3-11,14-19,22H,20-21H2,1-2H3
InChIKey PQHGCRLURSYIES-UHFFFAOYSA-N
Mol Weight 382.5 g/mol
Molecular Formula C27H26O2
Exact Mass 382.19328 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FUuHWpHYQXq
Name 4-Methyl-5-heptyn-2-one, 7-methoxy-1,1,1-triphenyl-
Alternate Name(s) 7-Methoxy-4-methyl-1,1,1-triphenyl-5-heptyn-2-one 7-Methoxy-4-methyl-1,1,1-triphenyl-hept-5-yn-2-one
CAS Registry Number 78167-35-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H26O2
InChI InChI=1S/C27H26O2/c1-22(13-12-20-29-2)21-26(28)27(23-14-6-3-7-15-23,24-16-8-4-9-17-24)25-18-10-5-11-19-25/h3-11,14-19,22H,20-21H2,1-2H3
InChIKey PQHGCRLURSYIES-UHFFFAOYSA-N
Molecular Weight 382.503 g/mol
SMILES c1(C(c2ccccc2)(c2ccccc2)C(CC(C)C#CCOC)=O)ccccc1
SPLASH splash10-0006-0290000000-f5d0a559ddc720c94a67
Wiley ID 1479717