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1,11-Ethanocyclopentacycloundecen-13-one, 5,14-bis(acetyloxy)-1,2,3,3a,4,5,6,7,8,9,10,12a-dodecahydro-1,8,12-tr imethyl-4-methylene-, [1S-(1R*,3aS*,5S*,8S*,12aR*,14S*)]-
SpectraBase Compound ID 2cxDNBbUF3y
InChI InChI=1S/C24H34O5/c1-13-7-9-19-15(3)21-18(14(2)20(10-8-13)28-16(4)25)11-12-24(21,6)23(27)22(19)29-17(5)26/h13,18,20-22H,2,7-12H2,1,3-6H3/t13-,18+,20-,21-,22-,24+/m1/s1
InChIKey MHNDCPODVSRYKH-CDLAHDLGSA-N
Mol Weight 402.5 g/mol
Molecular Formula C24H34O5
Exact Mass 402.240624 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B3njMjAfrMW
Name 1,11-Ethanocyclopentacycloundecen-13-one, 5,14-bis(acetyloxy)-1,2,3,3a,4,5,6,7,8,9,10,12a-dodecahydro-1,8,12-tr imethyl-4-methylene-, [1S-(1R*,3aS*,5S*,8S*,12aR*,14S*)]-
CAS Registry Number 78708-81-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H34O5
InChI InChI=1S/C24H34O5/c1-13-7-9-19-15(3)21-18(14(2)20(10-8-13)28-16(4)25)11-12-24(21,6)23(27)22(19)29-17(5)26/h13,18,20-22H,2,7-12H2,1,3-6H3/t13-,18+,20-,21-,22-,24+/m1/s1
InChIKey MHNDCPODVSRYKH-CDLAHDLGSA-N
Molecular Weight 402.531 g/mol
SMILES [C@]12([C@@]3(C(C)=C([C@](C2=O)(OC(=O)C)[H])CC[C@@](C)(CC[C@](C([C@]3([H])CC1)=C)(OC(=O)C)[H])[H])[H])C
SPLASH splash10-0udr-0914000000-2980c257163af4010aac
Source of Spectrum AN-90-498-0
Synonyms (1R,3R,6R,10R,12S,15S)-10-(acetyloxy)-6,12,16-trimethyl-2-methylene-11-oxotricyclo[7.5.2.0(12,15)]hexadec-9(16)-en-3-yl acetate 3.alpha.,9.alpha.-diacetoxy-2-oxo-trinervita-1(15),8(19)-diene
Wiley ID 1370492