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7-Cyclopentacycloundecenol, 1,2,4,7,8,11,12,12a-octahydro-6,10,12a-trimethyl-1-(1-methylethyl)-, acetate, (1R*,5E,7R*,9E,12aR*)-(+)-

View entire compound with spectra: 1 MS (GC)

7-Cyclopentacycloundecenol, 1,2,4,7,8,11,12,12a-octahydro-6,10,12a-trimethyl-1-(1-methylethyl)-, acetate, (1R*,5E,7R*,9E,12aR*)-(+)-
SpectraBase Compound ID 5QjwqFk1t3L
InChI InChI=1S/C22H34O2/c1-15(2)20-11-10-19-9-8-17(4)21(24-18(5)23)12-7-16(3)13-14-22(19,20)6/h7-8,10,15,20-21H,9,11-14H2,1-6H3/b16-7-,17-8-/t20-,21?,22+/m1/s1
InChIKey GWWITIDAXOKUFX-CUEVXLDASA-N
Mol Weight 330.5 g/mol
Molecular Formula C22H34O2
Exact Mass 330.25588 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8fTmShHwVOk
Name 7-Cyclopentacycloundecenol, 1,2,4,7,8,11,12,12a-octahydro-6,10,12a-trimethyl-1-(1-methylethyl)-, acetate, (1R*,5E,7R*,9E,12aR*)-(+)-
CAS Registry Number 68978-06-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H34O2
InChI InChI=1S/C22H34O2/c1-15(2)20-11-10-19-9-8-17(4)21(24-18(5)23)12-7-16(3)13-14-22(19,20)6/h7-8,10,15,20-21H,9,11-14H2,1-6H3/b16-7-,17-8-/t20-,21?,22+/m1/s1
InChIKey GWWITIDAXOKUFX-CUEVXLDASA-N
Molecular Weight 330.512 g/mol
SMILES [C@]12(C(=CC[C@@]2(C(C)C)[H])C\C=C/(C(OC(=O)C)C\C=C/(CC1)C)C)C
SPLASH splash10-00ac-3960000000-37876603814f153b8b39
Source of Spectrum B-31-2046-0
Synonyms (1R,12aR)-1-isopropyl-6,10,12a-trimethyl-1,2,4,7,8,11,12,12a-octahydrocyclopenta[a]cycloundecen-7-yl acetate (3Z,5E,9E,1R*,12aR*)-1-isopropyl-6,10,12a-trimethyl-7-acetoxy-1,2,4,7,8,11,12,12a-octahydrocyclopentacycloundecene
Wiley ID 1328334