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9,10-Secochola-5,7,10(19)-trien-24-al, 3-hydroxy-, (3.beta.,5Z,7E)-
SpectraBase Compound ID 8ikLZuosZhh
InChI InChI=1S/C24H36O2/c1-17-8-11-21(26)16-20(17)10-9-19-7-4-14-24(3)22(12-13-23(19)24)18(2)6-5-15-25/h9-10,15,18,21-23,26H,1,4-8,11-14,16H2,2-3H3/b19-9+,20-10-
InChIKey XNOYBBBNYOXXCG-ZERQYDHYSA-N
Mol Weight 356.6 g/mol
Molecular Formula C24H36O2
Exact Mass 356.27153 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID girBkDEYq
Name 9,10-Secochola-5,7,10(19)-trien-24-al, 3-hydroxy-, (3.beta.,5Z,7E)-
CAS Registry Number 40013-88-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H36O2
InChI InChI=1S/C24H36O2/c1-17-8-11-21(26)16-20(17)10-9-19-7-4-14-24(3)22(12-13-23(19)24)18(2)6-5-15-25/h9-10,15,18,21-23,26H,1,4-8,11-14,16H2,2-3H3/b19-9+,20-10-
InChIKey XNOYBBBNYOXXCG-ZERQYDHYSA-N
Molecular Weight 356.550 g/mol
SMILES OC1C\C(=C\C=C\2C3CCC(C(C)CCC=O)C3(CCC2)C)C(CC1)=C
SPLASH splash10-0670-7900000000-419373dfe0a83d435d55
Source of Spectrum D-11-4253-3
Synonyms 25,26,27-Trinorcholecalcifer-24-al 25,26,27-Trisnorcholecalcif-24-al 4-[(4E)-4-[(2Z)-2-(5-hydroxy-2-methylene-cyclohexylidene)ethylidene]-7a-methyl-2,3,3a,5,6,7-hexahydro-1H-inden-1-yl]pentanal 4-[(4E)-4-[(2Z)-2-(5-hydroxy-2-methylene-cyclohexylidene)ethylidene]-7a-methyl-2,3,3a,5,6,7-hexahydro-1H-inden-1-yl]valeraldehyde 4-[(4E)-4-[(2Z)-2-(5-hydroxy-2-methylidenecyclohexylidene)ethylidene]-7a-methyl-2,3,3a,5,6,7-hexahydro-1H-inden-1-yl]pentanal 4-[(4E)-7a-methyl-4-[(2Z)-2-(2-methylidene-5-oxidanyl-cyclohexylidene)ethylidene]-2,3,3a,5,6,7-hexahydro-1H-inden-1-yl]pentanal
Wiley ID 1346205