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(1S,1aR,4aR,7S,7aR,7bR)-1,7-dimethyl-4-methylene-1-(4-methylpent-3-enyl)decahydro-1H-cyclopropa[e]azulen-7-yl acetate
SpectraBase Compound ID 8S1jxru8WZC
InChI InChI=1S/C22H34O2/c1-14(2)8-7-12-21(5)18-10-9-15(3)17-11-13-22(6,24-16(4)23)19(17)20(18)21/h8,17-20H,3,7,9-13H2,1-2,4-6H3/t17-,18+,19+,20+,21-,22-/m0/s1
InChIKey OAYLLNSWTRYMQN-JVTHYKSUSA-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 WMw86nxNg
Name (1S,1aR,4aR,7S,7aR,7bR)-1,7-dimethyl-4-methylene-1-(4-methylpent-3-enyl)decahydro-1H-cyclopropa[e]azulen-7-yl acetate
Alternate Name(s) (1S,1aR,4aR,7S,7aR,7bR)-1,7-dimethyl-4-methylene-1-(4-methylpent-3-en-1-yl)decahydro-1H-cyclopropa[e]azulen-7-yl acetate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H34O2
InChI InChI=1S/C22H34O2/c1-14(2)8-7-12-21(5)18-10-9-15(3)17-11-13-22(6,24-16(4)23)19(17)20(18)21/h8,17-20H,3,7,9-13H2,1-2,4-6H3/t17-,18+,19+,20+,21-,22-/m0/s1
InChIKey OAYLLNSWTRYMQN-JVTHYKSUSA-N
Literature Reference DOI 10.1002/cber.19801131217
Molecular Weight 330.512 g/mol
SMILES [C@]12([C@]([C@]3([C@]([C@]3(C)CCC=C(C)C)(CCC1=C)[H])[H])([C@](CC2)(OC(C)=O)C)[H])[H]
SPLASH splash10-0q2a-5890000000-3e1372680e2b8392372b
Source of Spectrum K-113-3860-25_[Acetate]
Wiley ID 1794386