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21H-Biline-1,19-dione, 3,17-diethyl-22,24-dihydro-10-(1H-imidazol-2-yl)-2,7,8,12,13,18-hexamethyl-
SpectraBase Compound ID 4xJZd3mDN14
InChI InChI=1S/C32H36N6O2/c1-9-21-19(7)31(39)37-25(21)13-23-15(3)17(5)28(35-23)27(30-33-11-12-34-30)29-18(6)16(4)24(36-29)14-26-22(10-2)20(8)32(40)38-26/h11-14,35H,9-10H2,1-8H3,(H,33,34)(H,37,39)(H,38,40)/b25-13-,26-14+,29-27-
InChIKey JBAGVCVCMHPCSB-RTLSEIQXSA-N
Mol Weight 536.7 g/mol
Molecular Formula C32H36N6O2
Exact Mass 536.289974 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BG0hveLLlhu
Name 21H-Biline-1,19-dione, 3,17-diethyl-22,24-dihydro-10-(1H-imidazol-2-yl)-2,7,8,12,13,18-hexamethyl-
Alternate Name(s) (5Z)-4-ethyl-5-({5-[(Z)-{5-[(E)-(3-ethyl-4-methyl-5-oxo-1,5-dihydro-2H-pyrrol-2-ylidene)methyl]-3,4-dimethyl-2H-pyrrol-2-ylidene}(1H-imidazol-2-yl)methyl]-3,4-dimethyl-1H-pyrrol-2-yl}methylene)-3-methyl-1,5-dihydro-2H-pyrrol-2-one (Z,Z,Z)-3,17-diethyl-2,7,8,12,13,18-hexamethyl-10-(2-imidazolyl)-1,19,21,24-tetrahydro-23H-bilin-1,19-dion
CAS Registry Number 115693-55-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C32H36N6O2
InChI InChI=1S/C32H36N6O2/c1-9-21-19(7)31(39)37-25(21)13-23-15(3)17(5)28(35-23)27(30-33-11-12-34-30)29-18(6)16(4)24(36-29)14-26-22(10-2)20(8)32(40)38-26/h11-14,35H,9-10H2,1-8H3,(H,33,34)(H,37,39)(H,38,40)/b25-13-,26-14+,29-27-
InChIKey JBAGVCVCMHPCSB-RTLSEIQXSA-N
Molecular Weight 536.680 g/mol
SMILES [nH]1c(\C(c2ncc[nH]2)=C\2N=C(\C=C\3NC(C(=C3CC)C)=O)C(=C2C)C)c(c(C)c1\C=C/1NC(C(=C1CC)C)=O)C
SPLASH splash10-01w0-0841090000-991ce937f2d4415980c4
Source of Spectrum AH-118-1314-3
Wiley ID 1404115