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D-Friedoolean-14-en-3-one
SpectraBase Compound ID 6PZgsPFn1Q5
InChI InChI=1S/C30H48O/c1-25(2)17-18-27(5)13-9-21-29(7)14-10-20-26(3,4)24(31)12-16-28(20,6)22(29)11-15-30(21,8)23(27)19-25/h9,20,22-23H,10-19H2,1-8H3/t20?,22-,23-,27+,28+,29+,30-/m1/s1
InChIKey DBCAVZSSFGIHQZ-KRKLTRGOSA-N
Mol Weight 424.7 g/mol
Molecular Formula C30H48O
Exact Mass 424.370516 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID s3LbcFro8
Name D-Friedoolean-14-en-3-one
CAS Registry Number 514-07-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C30H48O
InChI InChI=1S/C30H48O/c1-25(2)17-18-27(5)13-9-21-29(7)14-10-20-26(3,4)24(31)12-16-28(20,6)22(29)11-15-30(21,8)23(27)19-25/h9,20,22-23H,10-19H2,1-8H3/t20?,22-,23-,27+,28+,29+,30-/m1/s1
InChIKey DBCAVZSSFGIHQZ-KRKLTRGOSA-N
Molecular Weight 424.713 g/mol
SMILES C=12[C@]3([C@]([C@]4(CCC(C(C4CC3)(C)C)=O)C)([H])CC[C@]2([C@@]2(CC(C)(C)CC[C@@]2(CC1)C)[H])C)C
SPLASH splash10-0gir-0962100000-e473a37fb629a520824c
Source of Spectrum Va-0-0-0
Synonyms 4,4,6a,8a,11,11,12b,14b-Octamethyl-1,4,4a,5,6,6a,8,8a,9,10,11,12,12a,12b,13,14,14a,14b-octadecahydro-3(2H)-picenone (6aR,6aS,8aR,14bR)-4,4,6a,6a,8a,11,11,14b-octamethyl-2,4a,5,6,8,9,10,12,12a,13,14,14a-dodecahydro-1H-picen-3-one .delta.14-Taraxene-3-one Skimmione Taraxer-14-en-3-one Taraxeron Taraxerone
Wiley ID 741861