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Butyl-(4-{[(2E,4E,6E,8E)-3,7-Dimethyl-9-(2,6,6-trimethyl-1-cyclohexenyl)-2,4,6,8-nonatetraenoyl]amino}phenyl) hydrogen phosphate
SpectraBase Compound ID HhyMk9rmHqN
InChI InChI=1S/C30H42NO5P/c1-7-8-21-35-37(33,34)36-27-17-15-26(16-18-27)31-29(32)22-24(3)12-9-11-23(2)14-19-28-25(4)13-10-20-30(28,5)6/h9,11-12,14-19,22H,7-8,10,13,20-21H2,1-6H3,(H,31,32)(H,33,34)/b12-9+,19-14+,23-11+,24-22+
InChIKey HQCIKIPHNNTYJG-BLXWSQONSA-N
Mol Weight 527.6 g/mol
Molecular Formula C30H42NO5P
Exact Mass 527.28006 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2L0BMvDanO2
Name Butyl-(4-{[(2E,4E,6E,8E)-3,7-Dimethyl-9-(2,6,6-trimethyl-1-cyclohexenyl)-2,4,6,8-nonatetraenoyl]amino}phenyl) hydrogen phosphate
Alternate Name(s) 15-(4-{[Butoxy(hydroxy)phosphoryl]oxy}anilino)retinal
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C30H42NO5P
InChI InChI=1S/C30H42NO5P/c1-7-8-21-35-37(33,34)36-27-17-15-26(16-18-27)31-29(32)22-24(3)12-9-11-23(2)14-19-28-25(4)13-10-20-30(28,5)6/h9,11-12,14-19,22H,7-8,10,13,20-21H2,1-6H3,(H,31,32)(H,33,34)/b12-9+,19-14+,23-11+,24-22+
InChIKey HQCIKIPHNNTYJG-BLXWSQONSA-N
Molecular Weight 527.642 g/mol
SMILES N(C(\C=C\(\C=C\C=C\(\C=C\C1=C(CCCC1(C)C)C)C)C)=O)c1ccc(OP(=O)(O)OCCCC)cc1
SPLASH splash10-0ar0-3921040000-8ef5dc2a867d84771422
Source of Spectrum QC-23-1809-9
Wiley ID 1584000