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(1S,3R,4R)-2-[(S)-1-Phenylethylamino]-2-azabicyclo[2.2.1]heptane-3(S)-phenylmethanol
SpectraBase Compound ID 7GOXkFSBoj9
InChI InChI=1S/C21H25NO/c1-15(16-8-4-2-5-9-16)22-19-13-12-18(14-19)20(22)21(23)17-10-6-3-7-11-17/h2-11,15,18-21,23H,12-14H2,1H3/t15-,18+,19-,20-,21-/m0/s1
InChIKey UJJAAJRKUCQNAK-YSCIFQABSA-N
Mol Weight 307.44 g/mol
Molecular Formula C21H25NO
Exact Mass 307.193614 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LvGRAqhO1aH
Name (1S,3R,4R)-2-[(S)-1-Phenylethylamino]-2-azabicyclo[2.2.1]heptane-3(S)-phenylmethanol
Alternate Name(s) (S)-Phenyl-[2-((S)-1-phenyl-ethyl)-2-aza-bicyclo[2.2.1]hept-3-yl]-methanol
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H25NO
InChI InChI=1S/C21H25NO/c1-15(16-8-4-2-5-9-16)22-19-13-12-18(14-19)20(22)21(23)17-10-6-3-7-11-17/h2-11,15,18-21,23H,12-14H2,1H3/t15-,18+,19-,20-,21-/m0/s1
InChIKey UJJAAJRKUCQNAK-YSCIFQABSA-N
Molecular Weight 307.437 g/mol
SMILES O[C@]([C@]1(N([C@@]2(C[C@]1(CC2)[H])[H])[C@](c1ccccc1)(C)[H])[H])(c1ccccc1)[H]
SPLASH splash10-0a4i-0900000000-7bb644a802cb88f31677
Source of Spectrum QE-5-1697-13
Wiley ID 844217