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HBMHQOPVLMZZBO-UHFFFAOYSA-N

View entire compound with spectra: 2 NMR, and 1 MS (GC)

HBMHQOPVLMZZBO-UHFFFAOYSA-N
SpectraBase Compound ID JfGD2EO0Cho
InChI InChI=1S/C32H31N4P/c1-3-24-33-25-31-26(2)34-36(27-16-8-4-9-17-27)32(31)35-37(28-18-10-5-11-19-28,29-20-12-6-13-21-29)30-22-14-7-15-23-30/h3-23,33H,1,24-25H2,2H3
InChIKey HBMHQOPVLMZZBO-UHFFFAOYSA-N
Mol Weight 502.6 g/mol
Molecular Formula C32H31N4P
Exact Mass 502.228634 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Lp9dnepjIjN
Name 4-(Prop-2-en-1-yl)aminomethyl-3-methyl-1-phenyl-5-[(triphenylphosphoranylidene)amino]-1H-pyrazole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C32H31N4P
InChI InChI=1S/C32H31N4P/c1-3-24-33-25-31-26(2)34-36(27-16-8-4-9-17-27)32(31)35-37(28-18-10-5-11-19-28,29-20-12-6-13-21-29)30-22-14-7-15-23-30/h3-23,33H,1,24-25H2,2H3
InChIKey HBMHQOPVLMZZBO-UHFFFAOYSA-N
Molecular Weight 502.602 g/mol
SMILES N(Cc1c(n[n](c1N=P(c1ccccc1)(c1ccccc1)c1ccccc1)-c1ccccc1)C)CC=C
SPLASH splash10-053s-2900300000-93bfccecf9aaa9de6769
Source of Spectrum SO-0-470-2
Synonyms N-({3-methyl-1-phenyl-5-[(triphenylphosphoranylidene)amino]-1H-pyrazol-4-yl}methyl)-2-propen-1-amine N-allyl-N-({3-methyl-1-phenyl-5-[(triphenylphosphoranylidene)amino]-1H-pyrazol-4-yl}methyl)amine
Wiley ID 1541360