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(Rp,Sc)-2-(13-{[1-Hydroxymethyl-2-methyl-butylimino]-methyl}-tricyclo[8.2.2.2(4,7)]hexadeca-1(13),4(16),5,7(15),10(14),11-hexaen-5-yl)-phenol

View entire compound with spectra: 2 MS (GC)

(Rp,Sc)-2-(13-{[1-Hydroxymethyl-2-methyl-butylimino]-methyl}-tricyclo[8.2.2.2(4,7)]hexadeca-1(13),4(16),5,7(15),10(14),11-hexaen-5-yl)-phenol
SpectraBase Compound ID AWa0KsI2iYd
InChI InChI=1S/C29H33NO2/c1-3-20(2)28(19-31)30-18-25-16-21-8-9-22-11-13-24(15-14-23(25)12-10-21)27(17-22)26-6-4-5-7-29(26)32/h4-7,10-13,16-18,20,28,31-32H,3,8-9,14-15,19H2,1-2H3/t20?,28-/m1/s1
InChIKey ZYFMULGENAMGQH-VLEDXSGQSA-N
Mol Weight 427.6 g/mol
Molecular Formula C29H33NO2
Exact Mass 427.251129 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Awytiy6lJEB
Name (Rp,Sc)-2-(13-{[1-Hydroxymethyl-2-methyl-butylimino]-methyl}-tricyclo[8.2.2.2(4,7)]hexadeca-1(13),4(16),5,7(15),10(14),11-hexaen-5-yl)-phenol
Alternate Name(s) 2-(4(2)-((((2S)-1-hydroxy-3-methylpentan-2-yl)imino)methyl)-1,4(1,4)-dibenzenacyclohexaphane-1(2)-yl)phenol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C29H33NO2
InChI InChI=1S/C29H33NO2/c1-3-20(2)28(19-31)30-18-25-16-21-8-9-22-11-13-24(15-14-23(25)12-10-21)27(17-22)26-6-4-5-7-29(26)32/h4-7,10-13,16-18,20,28,31-32H,3,8-9,14-15,19H2,1-2H3/t20?,28-/m1/s1
InChIKey ZYFMULGENAMGQH-VLEDXSGQSA-N
Literature Reference DOI 10.1002/ijch.201100096
Molecular Weight 427.588 g/mol
SMILES Oc1c(-c2c3ccc(CCc4ccc(c(C=N[C@](CO)(C(C)CC)[H])c4)CC3)c2)cccc1
SPLASH splash10-001j-0916000000-ba95372d6b8826a2b3a6
Source of Spectrum TI-52-168-(Rp,Sc)_30
Wiley ID 1808423