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26,27-Dinorergosta-5,24-dien-3-ol, 23,23-dimethyl-, (3.beta.)-
SpectraBase Compound ID 2vg3J1bmvcj
InChI InChI=1S/C28H46O/c1-18(2)26(4,5)17-19(3)23-10-11-24-22-9-8-20-16-21(29)12-14-27(20,6)25(22)13-15-28(23,24)7/h8,19,21-25,29H,1,9-17H2,2-7H3/t19-,21+,22+,23-,24+,25+,27+,28-/m1/s1
InChIKey QHKPPFGESCCOIN-JDTILAPWSA-N
Mol Weight 398.7 g/mol
Molecular Formula C28H46O
Exact Mass 398.354866 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID TvelaQEFuw
Name 26,27-Dinorergosta-5,24-dien-3-ol, 23,23-dimethyl-, (3.beta.)-
Alternate Name(s) (1S,2R,5S,10S,11S,14R,15R)-2,15-dimethyl-14-[(2R)-4,4,5-trimethylhex-5-en-2-yl]tetracyclo[8.7.0.0(2,7).0(11,15)]heptadec-7-en-5-ol 23,23-Dimethyl-26,27-dinorergosta-5,24-dien-3.beta.-ol
CAS Registry Number 119879-36-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H46O
InChI InChI=1S/C28H46O/c1-18(2)26(4,5)17-19(3)23-10-11-24-22-9-8-20-16-21(29)12-14-27(20,6)25(22)13-15-28(23,24)7/h8,19,21-25,29H,1,9-17H2,2-7H3/t19-,21+,22+,23-,24+,25+,27+,28-/m1/s1
InChIKey QHKPPFGESCCOIN-JDTILAPWSA-N
Molecular Weight 398.675 g/mol
SMILES O[C@]1(CC[C@@]2([C@]3(CC[C@]4([C@]([C@@]3(CC=C2C1)[H])(CC[C@@]4([C@@](CC(C(=C)C)(C)C)(C)[H])[H])[H])C)[H])C)[H]
SPLASH splash10-001i-9000000000-a7dbfe6b51c6b12ce4b2
Source of Spectrum J-54-2123-52
Wiley ID 1368801