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rac-(3aR,5R,7S,7aR)-5-(5-chloro-2-methylphenyl)-1-isopropyl-3,3,7-trimethyloctahydrobenzo[c]Isoxazole
SpectraBase Compound ID ELnEgQM4QbZ
InChI InChI=1S/C20H30ClNO/c1-12(2)22-19-14(4)9-15(10-18(19)20(5,6)23-22)17-11-16(21)8-7-13(17)3/h7-8,11-12,14-15,18-19H,9-10H2,1-6H3/t14-,15+,18+,19+/m0/s1
InChIKey JFEUGMKDSVIJMO-OSGQAZFXSA-N
Mol Weight 335.92 g/mol
Molecular Formula C20H30ClNO
Exact Mass 335.201592 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DdcS0KNzKp8
Name rac-(3aR,5R,7S,7aR)-5-(5-chloro-2-methylphenyl)-1-isopropyl-3,3,7-trimethyloctahydrobenzo[c]Isoxazole
Appearance Pale yellow oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H30ClNO
InChI InChI=1S/C20H30ClNO/c1-12(2)22-19-14(4)9-15(10-18(19)20(5,6)23-22)17-11-16(21)8-7-13(17)3/h7-8,11-12,14-15,18-19H,9-10H2,1-6H3/t14-,15+,18+,19+/m0/s1
InChIKey JFEUGMKDSVIJMO-OSGQAZFXSA-N
Instrument Name GCMS
Ionization Type EI
Molecular Weight 335.919 g/mol
SMILES [C@]1(C[C@@]2([C@](N(OC2(C)C)C(C)C)([C@](C1)(C)[H])[H])[H])(c1cc(ccc1C)Cl)[H]
SPLASH splash10-0fk9-0709000000-48c17251f442abf97d3e
Source of Spectrum CN114761385A
Wiley ID 1884448