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(3aR,9aR)-N-(8-Mentholyl)-6-methoxy-3a,4,9,9a-tetrahydrobenz[f]isoindoline
SpectraBase Compound ID 2zSEQ9vZOFf
InChI InChI=1S/C23H35NO2/c1-15-5-8-21(22(25)9-15)23(2,3)24-13-18-10-16-6-7-20(26-4)12-17(16)11-19(18)14-24/h6-7,12,15,18-19,21-22,25H,5,8-11,13-14H2,1-4H3/t15-,18+,19+,21-,22-/m1/s1
InChIKey BBXDWMDCWNQFIY-IRIUZCNHSA-N
Mol Weight 357.5 g/mol
Molecular Formula C23H35NO2
Exact Mass 357.266779 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HnwRTEXZyA8
Name (3aR,9aR)-N-(8-Mentholyl)-6-methoxy-3a,4,9,9a-tetrahydrobenz[f]isoindoline
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H35NO2
InChI InChI=1S/C23H35NO2/c1-15-5-8-21(22(25)9-15)23(2,3)24-13-18-10-16-6-7-20(26-4)12-17(16)11-19(18)14-24/h6-7,12,15,18-19,21-22,25H,5,8-11,13-14H2,1-4H3/t15-,18+,19+,21-,22-/m1/s1
InChIKey BBXDWMDCWNQFIY-IRIUZCNHSA-N
Molecular Weight 357.538 g/mol
SMILES O[C@]1([C@](C(N2C[C@@]3(Cc4ccc(cc4C[C@]3(C2)[H])OC)[H])(C)C)(CC[C@@](C)(C1)[H])[H])[H]
SPLASH splash10-0006-9120000000-13e6aa02acf0cd467abf
Source of Spectrum J-67-787-9
Synonyms 2-{1-[(3aR,9aR)-6-methoxy-1,3,3a,4,9,9a-hexahydro-2H-benzo[f]isoindol-2-yl]-1-methylethyl}-5-methylcyclohexanol
Wiley ID 1569093