For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

(1R,3S,5Z)-5-[(E)-2-((1R,3aS,7aR)-Hexahydro-1-{(S)-1-[5-(2-hydroxypropan-2-yl)-1H-tetrazol-1-yl]propan-2-yl}-7a-methyl-1H-inden-4(7aH)-ylidene)ethylidene]-4-methylenecyclohexane-1,3-diol

Compound with spectra: 1 MS (GC)

(1R,3S,5Z)-5-[(E)-2-((1R,3aS,7aR)-Hexahydro-1-{(S)-1-[5-(2-hydroxypropan-2-yl)-1H-tetrazol-1-yl]propan-2-yl}-7a-methyl-1H-inden-4(7aH)-ylidene)ethylidene]-4-methylenecyclohexane-1,3-diol
SpectraBase Compound ID 8pVjYEioO2b
InChI InChI=1S/C26H40N4O3/c1-16(15-30-24(25(3,4)33)27-28-29-30)21-10-11-22-18(7-6-12-26(21,22)5)8-9-19-13-20(31)14-23(32)17(19)2/h8-9,16,20-23,31-33H,2,6-7,10-15H2,1,3-5H3/b18-8+,19-9-/t16-,20-,21-,22+,23+,26-/m1/s1
InChIKey BJPRCINLFKJDLQ-LBZBXKOVSA-N
Mol Weight 456.6 g/mol
Molecular Formula C26H40N4O3
Exact Mass 456.310041 g/mol
Enantiomer InChIKey BJPRCINLFKJDLQ-VZRGSHSKSA-N

View Spectrum of (1R,3S,5Z)-5-[(E)-2-((1R,3aS,7aR)-Hexahydro-1-{(S)-1-[5-(2-hydroxypropan-2-yl)-1H-tetrazol-1-yl]propan-2-yl}-7a-methyl-1H-inden-4(7aH)-ylidene)ethylidene]-4-methylenecyclohexane-1,3-diol

MS (GC) Spectrum
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Source of Spectrum F4-43-3891-4
25-Dehydro-1.alpha.-hydroxy-24-methyl-Vitamin D3-26,23-lactone
25-Dehydro-1.alpha.-hydroxy-24-propyl-Vitamin D3-26,23-lactone
F6-1,25-( OH)2-Vitamin D3 - tris(trimethylsilyl) derivative
(2S)-2-[(1R,3aS,4E,7aR)-4-[(2Z)-2-[(3S,5R)-3,5-bis[[tert-butyl(dimethyl)silyl]oxy]-2-methylene-cyclohexylidene]ethylidene]-7a-methyl-2,3,3a,5,6,7-hexahydro-1H-inden-1-yl]propan-1-ol
1,5-BIS-(TRI-ISOPROPYLSILYL)-1-ALPHA-HYDROXYVITAMIN-D(3)
(1R,3R,Z)-5-(2-((7aR,E)-1-((2R)-4,6-dihydroxy-6-methylheptan-2-yl)-7a-methyloctahydro-4H-inden-4-ylidene)ethylidene)-4-methylene-2-propoxycyclohexane-1,3-diol
1-OLEOYLOXYETHYL-3-O-(CHOLECALCIFERYL-3-O-)-(N,N-DIETHYLAMIDO)THIOPHOSPHATE
(3.beta.-5Z,7E,24R)-3-[(tert-Butyldimethylsilyl)oxy]-9,10-secocholesta-5,7,10(19)-triene-24,25-diol cyclic 24,25-(1-methylethylidene acetal)
(3.beta.,5Z,7E,24S)-3-[(tert-Butyldimethylsilyl)oxy]-9,10-secocholesta-5,7,10(19)-triene-24,25-diol cyclic 24,25-(1-methylethylidene acetal)
Tristrimethylsilyl ether derivative of 1,25-dihydroxyvitamin D2
Other Resources
Unknown Identification

Search your unknown spectrum against the world's largest collection of reference spectra

KnowItAll Campus Solutions

KnowItAll offers faculty and students at your school access to all the tools you need for spectral analysis and structure drawing & publishing! Plus, access the world's largest spectral library.