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4-Amino-3-(butyrylamino)phenyl (2E,4E,6E,8E)-[3,7-Dimethyl-9-(2,6,6-trimethyl-1-cyclohexenyl)nona-2,4,6,8-tetraenoate
SpectraBase Compound ID lUF6OvwLFw
InChI InChI=1S/C30H40N2O3/c1-7-10-28(33)32-26-20-24(31)15-17-27(26)35-29(34)19-22(3)12-8-11-21(2)14-16-25-23(4)13-9-18-30(25,5)6/h8,11-12,14-17,19-20H,7,9-10,13,18,31H2,1-6H3,(H,32,33)/b12-8+,16-14+,21-11+,22-19+
InChIKey IVEJABHKAMSFEP-WTVVCSNPSA-N
Mol Weight 476.7 g/mol
Molecular Formula C30H40N2O3
Exact Mass 476.303893 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BZokTAMF2D4
Name 4-Amino-3-(butyrylamino)phenyl (2E,4E,6E,8E)-[3,7-Dimethyl-9-(2,6,6-trimethyl-1-cyclohexenyl)nona-2,4,6,8-tetraenoate
Alternate Name(s) (2E,4E,6E,8E)-3,7-dimethyl-9-(2,6,6-trimethyl-1-cyclohexenyl)nona-2,4,6,8-tetraenoic acid [4-amino-2-(1-oxobutylamino)phenyl] ester [4-amino-2-(butanoylamino)phenyl] (2E,4E,6E,8E)-3,7-dimethyl-9-(2,6,6-trimethylcyclohexen-1-yl)nona-2,4,6,8-tetraenoate [4-azanyl-2-(butanoylamino)phenyl] (2E,4E,6E,8E)-3,7-dimethyl-9-(2,6,6-trimethylcyclohexen-1-yl)nona-2,4,6,8-tetraenoate
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Formula C30H40N2O3
InChI InChI=1S/C30H40N2O3/c1-7-10-28(33)32-26-20-24(31)15-17-27(26)35-29(34)19-22(3)12-8-11-21(2)14-16-25-23(4)13-9-18-30(25,5)6/h8,11-12,14-17,19-20H,7,9-10,13,18,31H2,1-6H3,(H,32,33)/b12-8+,16-14+,21-11+,22-19+
InChIKey IVEJABHKAMSFEP-WTVVCSNPSA-N
Molecular Weight 476.661 g/mol
SMILES N(c1c(ccc(c1)N)OC(\C=C\(\C=C\C=C\(\C=C\C1=C(CCCC1(C)C)C)C)C)=O)C(=O)CCC
SPLASH splash10-003r-0190600000-0967c43b8058757e35df
Source of Spectrum E2-52-505-5
Wiley ID 1556398