John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=GPaVCvo4xJU SpectraBase Spectrum ID=4x7HkaoDpuL

(accessed ).
3,11,20-Trioxopregn-4-en-21-al, 21-(phenylhydrazone)
SpectraBase Compound ID GPaVCvo4xJU
InChI InChI=1S/C27H32N2O3/c1-26-13-12-19(30)14-17(26)8-9-20-21-10-11-22(27(21,2)15-23(31)25(20)26)24(32)16-28-29-18-6-4-3-5-7-18/h3-7,14,16,20-22,25,29H,8-13,15H2,1-2H3/b28-16+/t20-,21-,22+,25+,26-,27-/m0/s1
InChIKey IQANMRRWKRANOA-XSLMCCSRSA-N
Mol Weight 432.6 g/mol
Molecular Formula C27H32N2O3
Exact Mass 432.241293 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID 4x7HkaoDpuL
Name 3,11,20-Trioxopregn-4-en-21-al, 21-(phenylhydrazone)
Source of Sample M. L. LEWBART, CROZER-CHESTER MEDICAL CENTER, CHESTER, PENNSYLVANIA
Copyright Copyright © 1980, 1981-2021 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H32N2O3
InChI InChI=1S/C27H32N2O3/c1-26-13-12-19(30)14-17(26)8-9-20-21-10-11-22(27(21,2)15-23(31)25(20)26)24(32)16-28-29-18-6-4-3-5-7-18/h3-7,14,16,20-22,25,29H,8-13,15H2,1-2H3/b28-16+/t20-,21-,22+,25+,26-,27-/m0/s1
InChIKey IQANMRRWKRANOA-XSLMCCSRSA-N
Melting Point 147.5-149.5C
Molecular Weight 432.563995
SpectraBase Batch ID HRsZD8FfgAE
Synonyms PREGN-4-EN-21-AL, 3,11,20-TRIOXO-, 21-/PHENYLHYDRAZONE/
Technique KBr WAFER