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2-[N-[(diphenylphosphinoyl)methyl]-N-(prop-2-yn-1-yl)amino]-N',N'-diethylbenzamide
SpectraBase Compound ID LmAsu9OaZ17
InChI InChI=1S/C27H29N2O2P/c1-4-21-29(26-20-14-13-19-25(26)27(30)28(5-2)6-3)22-32(31,23-15-9-7-10-16-23)24-17-11-8-12-18-24/h1,7-20H,5-6,21-22H2,2-3H3
InChIKey NQRSXMVQYYJRQC-UHFFFAOYSA-N
Mol Weight 444.51 g/mol
Molecular Formula C27H29N2O2P
Exact Mass 444.196665 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5kVG6z8ZA1w
Name 2-[N-[(diphenylphosphinoyl)methyl]-N-(prop-2-yn-1-yl)amino]-N',N'-diethylbenzamide
Alternate Name(s) 2-[[(diphenylphosphoryl)methyl](2-propynyl)amino]-N,N-diethylbenzamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H29N2O2P
InChI InChI=1S/C27H29N2O2P/c1-4-21-29(26-20-14-13-19-25(26)27(30)28(5-2)6-3)22-32(31,23-15-9-7-10-16-23)24-17-11-8-12-18-24/h1,7-20H,5-6,21-22H2,2-3H3
InChIKey NQRSXMVQYYJRQC-UHFFFAOYSA-N
Molecular Weight 444.515 g/mol
SMILES c1(C(N(CC)CC)=O)c(N(CP(=O)(c2ccccc2)c2ccccc2)CC#C)cccc1
SPLASH splash10-000i-9040000000-0d3147d3690eb7659a01
Source of Spectrum F-49-1435-1
Wiley ID 1386097