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3-Nonen-5-one, 9-(5-ethenyl-2-methyl-3,8-dioxabicyclo[3.2.1]oct-2-yl)-2,3,6-trimethyl-, O-methyloxime, [1R-[1.alpha.,2.beta.(3E,6R*),5.alpha.]]-
SpectraBase Compound ID FYz0LpoxHdV
InChI InChI=1S/C22H37NO3/c1-8-22-13-11-20(26-22)21(6,25-15-22)12-9-10-17(4)19(23-24-7)14-18(5)16(2)3/h8,14,16-17,20H,1,9-13,15H2,2-7H3/b18-14+,23-19-/t17-,20-,21-,22+/m1/s1
InChIKey CUSPRWMQBOKRMV-QEPKBURJSA-N
Mol Weight 363.5 g/mol
Molecular Formula C22H37NO3
Exact Mass 363.277344 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3mIFv04IHQ
Name 3-Nonen-5-one, 9-(5-ethenyl-2-methyl-3,8-dioxabicyclo[3.2.1]oct-2-yl)-2,3,6-trimethyl-, O-methyloxime, [1R-[1.alpha.,2.beta.(3E,6R*),5.alpha.]]-
CAS Registry Number 80368-93-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H37NO3
InChI InChI=1S/C22H37NO3/c1-8-22-13-11-20(26-22)21(6,25-15-22)12-9-10-17(4)19(23-24-7)14-18(5)16(2)3/h8,14,16-17,20H,1,9-13,15H2,2-7H3/b18-14+,23-19-/t17-,20-,21-,22+/m1/s1
InChIKey CUSPRWMQBOKRMV-QEPKBURJSA-N
Molecular Weight 363.542 g/mol
SMILES C(\C(=C\C(=N\OC)[C@@](CCC[C@]1(OC[C@]2(O[C@@]1(CC2)[H])C=C)C)(C)[H])C)(C)C
SPLASH splash10-02u0-8922000000-c84abb62fd941e38f4c9
Source of Spectrum 0-16-282-1
Synonyms (1R,4S,5R)-1-Ethinyl-4-(5'-methoxyimino-4',7',8'-trimethyl-6'-noneyl)-4-methyl-3,8-dioxabicyclo(3.2.1)octane (E)-[(3E,6R)-9-[(1R,2R,5R)-5-ethenyl-2-methyl-3,8-dioxabicyclo[3.2.1]octan-2-yl]-2,3,6-trimethylnon-3-en-5-ylidene](methoxy)amine 3,8-Dioxabicyclo[3.2.1]octane, 3-nonen-5-one deriv.
Wiley ID 1350340