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2-(1-benzotriazolyl)-1-(4-methoxyphenyl)-2-tributylphosphoranylideneethanone
SpectraBase Compound ID 6Gkgj1xU1lH
InChI InChI=1S/C27H38N3O2P/c1-5-8-19-33(20-9-6-2,21-10-7-3)27(26(31)22-15-17-23(32-4)18-16-22)30-25-14-12-11-13-24(25)28-29-30/h11-18H,5-10,19-21H2,1-4H3
InChIKey WJMPSTHPESFVRN-UHFFFAOYSA-N
Mol Weight 467.6 g/mol
Molecular Formula C27H38N3O2P
Exact Mass 467.270164 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AS1ZRnk4azK
Name 2-(1-benzotriazolyl)-1-(4-methoxyphenyl)-2-tributylphosphoranylideneethanone
Alternate Name(s) 2-(benzotriazol-1-yl)-1-(4-methoxyphenyl)-2-tributylphosphoranylidene-ethanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H38N3O2P
InChI InChI=1S/C27H38N3O2P/c1-5-8-19-33(20-9-6-2,21-10-7-3)27(26(31)22-15-17-23(32-4)18-16-22)30-25-14-12-11-13-24(25)28-29-30/h11-18H,5-10,19-21H2,1-4H3
InChIKey WJMPSTHPESFVRN-UHFFFAOYSA-N
Molecular Weight 467.594 g/mol
SMILES c12nn[n](c2cccc1)C(C(c1ccc(cc1)OC)=O)=P(CCCC)(CCCC)CCCC
SPLASH splash10-002f-9700000000-7925a39a1f6fd2bd5cc8
Source of Spectrum KC-0-3110-2
Wiley ID 823682