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(4R,5R,6S)-5-Isopropyl-4,6-diphenyl-2-(p-methylphenyl)-1,2,3,4,5,6-hexahydrocyclopenta[c]pyrrol-5-ol
SpectraBase Compound ID BiRPpaf3GzN
InChI InChI=1S/C29H31NO/c1-20(2)29(31)27(22-10-6-4-7-11-22)25-18-30(24-16-14-21(3)15-17-24)19-26(25)28(29)23-12-8-5-9-13-23/h4-17,20,27-28,31H,18-19H2,1-3H3/t27-,28+,29+
InChIKey NZUNXWAIEHYTDC-WLNZHLEZSA-N
Mol Weight 409.57 g/mol
Molecular Formula C29H31NO
Exact Mass 409.240565 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3rK0G8q6O18
Name (4R,5R,6S)-5-Isopropyl-4,6-diphenyl-2-(p-methylphenyl)-1,2,3,4,5,6-hexahydrocyclopenta[c]pyrrol-5-ol
Alternate Name(s) (4R,6S)-5-isopropyl-2-(4-methylphenyl)-4,6-diphenyl-1,2,3,4,5,6-hexahydrocyclopenta[c]pyrrol-5-ol (4R,6S)-5-Isopropyl-4,6-diphenyl-2-(p-methylphenyl)-1,2,3,4,5,6-hexahydrocyclopenta[c]pyrrol-5-ol
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C29H31NO
InChI InChI=1S/C29H31NO/c1-20(2)29(31)27(22-10-6-4-7-11-22)25-18-30(24-16-14-21(3)15-17-24)19-26(25)28(29)23-12-8-5-9-13-23/h4-17,20,27-28,31H,18-19H2,1-3H3/t27-,28+,29+
InChIKey NZUNXWAIEHYTDC-WLNZHLEZSA-N
Molecular Weight 409.573 g/mol
SMILES O[C@]1([C@](C2=C([C@]1(c1ccccc1)[H])CN(C2)c1ccc(cc1)C)(c1ccccc1)[H])C(C)C
SPLASH splash10-000i-0009500000-bed6b057ab6bb658e7ca
Source of Spectrum K1-2003-781-26
Wiley ID 1520763