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9a,11a-dimethyl-1-(1,5-dimethylhexyl)-2,3,3a,3b,9,9a,9b,10,11,11a-decahydro-1H-cyclopenta[f]pyrrolo[2,1-a]isoquinolin-7(8H)-one
SpectraBase Compound ID LoR7ZO3oXlQ
InChI InChI=1S/C25H41NO/c1-17(2)7-6-8-18(3)20-9-10-21-19-13-16-26-23(27)12-15-25(26,5)22(19)11-14-24(20,21)4/h13,16-22H,6-12,14-15H2,1-5H3/t18-,19+,20-,21+,22+,24-,25-/m1/s1
InChIKey CMJQCWWPYNDMAP-BMYFLWORSA-N
Mol Weight 371.6 g/mol
Molecular Formula C25H41NO
Exact Mass 371.318815 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID Do1jp63FwLt
Name 9a,11a-DIMETHYL-1-(1,5-DIMETHYLHEXYL)-2,3,3a,3b,9,9a,9b,10,11,11a-DECAHYDRO-1H-CYCLOPENTA[f]PYRROLO[2,1-a]ISOQUINOLIN-7(8H)-ONE
Source of Sample J. W. Morzycki and W. J. Rodewald, University of Warsaw, Warsaw, Poland
Copyright Copyright © 1980, 1981-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H41NO
InChI InChI=1S/C25H41NO/c1-17(2)7-6-8-18(3)20-9-10-21-19-13-16-26-23(27)12-15-25(26,5)22(19)11-14-24(20,21)4/h13,16-22H,6-12,14-15H2,1-5H3/t18-,19+,20-,21+,22+,24-,25-/m1/s1
InChIKey CMJQCWWPYNDMAP-BMYFLWORSA-N
Literature Reference ACTA CHIM. ACAD. SCI. HUNG. 111, 395(1982) Abstract-Chemical Abstracts= 98, 198581E(1983)
Melting Point 102-103C
Molecular Weight 371.609009
Optical Properties Optical Rotation= (17C) -30.4 DEG
Synonyms A-NOR-5-AZACHOLEST-6-EN-3-ONE 1H-CYCLOPENTA/F/PYRROLO/2,1-A/ISOQUIN- OLIN-7/8H/-ONE, 9A,11A-DIMETHYL- 1-/1,5-DIMETHYLHEXYL/-2,3,3A,3B,9,9A,- 9B,10,11,11A-DECAHYDRO-,
Technique KBr WAFER