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[1-(2-Methylcinnamoyl)prop-1-ylidene]triphenylphosphorane
SpectraBase Compound ID 5jsjs9Bko4K
InChI InChI=1S/C31H29OP/c1-3-31(30(32)24-23-26-16-14-13-15-25(26)2)33(27-17-7-4-8-18-27,28-19-9-5-10-20-28)29-21-11-6-12-22-29/h4-24H,3H2,1-2H3/b24-23+
InChIKey OCCFRECKQFMKFS-WCWDXBQESA-N
Mol Weight 448.55 g/mol
Molecular Formula C31H29OP
Exact Mass 448.195603 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4uaVWV3Gk4
Name [1-(2-Methylcinnamoyl)prop-1-ylidene]triphenylphosphorane
Alternate Name(s) (1E)-1-(2-methylphenyl)-4-(triphenylphosphoranylidene)-1-hexen-3-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C31H29OP
InChI InChI=1S/C31H29OP/c1-3-31(30(32)24-23-26-16-14-13-15-25(26)2)33(27-17-7-4-8-18-27,28-19-9-5-10-20-28)29-21-11-6-12-22-29/h4-24H,3H2,1-2H3/b24-23+
InChIKey OCCFRECKQFMKFS-WCWDXBQESA-N
Molecular Weight 448.546 g/mol
SMILES C(=P(c1ccccc1)(c1ccccc1)c1ccccc1)(C(\C=C\c1c(C)cccc1)=O)CC
SPLASH splash10-01q9-0960500000-abd5b8c76410a466706e
Source of Spectrum KC-0-2628-7
Wiley ID 823158