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Friedelin
SpectraBase Compound ID GHjDFFXc8x
InChI InChI=1S/C30H50O/c1-20-21(31)9-10-22-27(20,5)12-11-23-28(22,6)16-18-30(8)24-19-25(2,3)13-14-26(24,4)15-17-29(23,30)7/h20,22-24H,9-19H2,1-8H3
InChIKey OFMXGFHWLZPCFL-UHFFFAOYSA-N
Mol Weight 426.7 g/mol
Molecular Formula C30H50O
Exact Mass 426.386166 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2Jjfq0yHdeQ
Name D:A-Friedooleanan-3-one
CAS Registry Number 559-74-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C30H50O
InChI InChI=1S/C30H50O/c1-20-21(31)9-10-22-27(20,5)12-11-23-28(22,6)16-18-30(8)24-19-25(2,3)13-14-26(24,4)15-17-29(23,30)7/h20,22-24H,9-19H2,1-8H3
InChIKey OFMXGFHWLZPCFL-UHFFFAOYSA-N
Molecular Weight 426.729 g/mol
SMILES C12(C(C3CC(C)(C)CCC3(CC2)C)(CCC2(C1CCC1(C(C(=O)CCC21)C)C)C)C)C
SPLASH splash10-0673-6193300000-6d97e36c0fe48771b558
Source of Spectrum E2-47-892-0
Synonyms Friedelin 4,4a,6b,8a,11,11,12b,14a-Octamethylicosahydro-3(2H)-picenone 3(2H)-picenone, eicosahydro-4,4a,6b,8a,11,11,12b,14a-octamethyl-, (4R,4aS,6bR,8aR,12bS,14aS)- 4,4a,6a,6b,8a,11,11,14a-octamethyl-2,4,5,6,6a,7,8,9,10,12,12a,13,14,14b-tetradecahydro-1H-picen-3-one Friedelan-3-one Friedeline Friedlein EINECS 209-205-1 NSC 55141
Wiley ID 1554967