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rac-4-methoxy-3-((3aR,5R,7R,7aR)-1,3,3,5,7-pentamethyloctahydrobenzo[c]isoxazole-5-yl)benzonitrile
SpectraBase Compound ID FXe64WwLYHF
InChI InChI=1S/C20H28N2O2/c1-13-10-20(4,11-16-18(13)22(5)24-19(16,2)3)15-9-14(12-21)7-8-17(15)23-6/h7-9,13,16,18H,10-11H2,1-6H3/t13-,16-,18-,20-/m1/s1
InChIKey VIKARZAAKQDDCW-SIKWWSQNSA-N
Mol Weight 328.46 g/mol
Molecular Formula C20H28N2O2
Exact Mass 328.215078 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7b5qOFS9Rf6
Name rac-4-methoxy-3-((3aR,5R,7R,7aR)-1,3,3,5,7-pentamethyloctahydrobenzo[c]isoxazole-5-yl)benzonitrile
Appearance Pale yellow oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H28N2O2
InChI InChI=1S/C20H28N2O2/c1-13-10-20(4,11-16-18(13)22(5)24-19(16,2)3)15-9-14(12-21)7-8-17(15)23-6/h7-9,13,16,18H,10-11H2,1-6H3/t13-,16-,18-,20-/m1/s1
InChIKey VIKARZAAKQDDCW-SIKWWSQNSA-N
Instrument Name GCMS
Ionization Type EI
Molecular Weight 328.456 g/mol
SMILES [C@@]1(C[C@@]2([C@](N(OC2(C)C)C)([C@@](C1)(C)[H])[H])[H])(C)c1cc(ccc1OC)C#N
SPLASH splash10-004i-3974000000-f61096295f7263de7300
Source of Spectrum CN114761385A
Wiley ID 1884402