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(7S)-2,8(19),12(20)-6,7,11-tris(Acetoxy)cembratiene-4-ol
SpectraBase Compound ID 26iYx7RUdHX
InChI InChI=1S/C26H40O7/c1-15(2)23-11-9-16(3)24(31-19(6)27)12-10-17(4)26(33-21(8)29)25(32-20(7)28)14-22(30)13-18(23)5/h13,15,22-26,30H,3-4,9-12,14H2,1-2,5-8H3/b18-13-
InChIKey RQEYTIASKNXLPK-AQTBWJFISA-N
Mol Weight 464.6 g/mol
Molecular Formula C26H40O7
Exact Mass 464.277404 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 12V33krGKHa
Name (7S)-2,8(19),12(20)-6,7,11-tris(Acetoxy)cembratiene-4-ol
Alternate Name(s) 10,11-bis(acetyloxy)-8-hydroxy-5-isopropyl-6-methyl-2,12-dimethylene-6-cyclotetradecen-1-yl acetate 7S-1-Isopropyl-2-methyl-8,12-bis(methylene)-4-hydroxy-6,7,11-tris(acetoxy)-cyclotetradec-2-ene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H40O7
InChI InChI=1S/C26H40O7/c1-15(2)23-11-9-16(3)24(31-19(6)27)12-10-17(4)26(33-21(8)29)25(32-20(7)28)14-22(30)13-18(23)5/h13,15,22-26,30H,3-4,9-12,14H2,1-2,5-8H3/b18-13-
InChIKey RQEYTIASKNXLPK-AQTBWJFISA-N
Molecular Weight 464.599 g/mol
SMILES OC1CC(C(C(=C)CCC(C(CCC(\C(=C/1)C)C(C)C)=C)OC(=O)C)OC(=O)C)OC(=O)C
SPLASH splash10-0006-9310000000-feac2009d5e451b3f3b7
Source of Spectrum SB-44-822-9
Wiley ID 744759