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(1S,3R,4R)-2-(Benzylamino)-2-azabicyclo[2.2.1]hepane-3(S)-isopropylmethanol

View entire compound with spectra: 1 MS (GC)

(1S,3R,4R)-2-(Benzylamino)-2-azabicyclo[2.2.1]hepane-3(S)-isopropylmethanol
SpectraBase Compound ID EB2EB3IhPwD
InChI InChI=1S/C17H25NO/c1-12(2)17(19)16-14-8-9-15(10-14)18(16)11-13-6-4-3-5-7-13/h3-7,12,14-17,19H,8-11H2,1-2H3/t14-,15+,16+,17+/m1/s1
InChIKey FEYYBOXHOAZXFW-QZWWFDLISA-N
Mol Weight 259.39 g/mol
Molecular Formula C17H25NO
Exact Mass 259.193614 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AYD9ELfdoub
Name (1S,3R,4R)-2-(Benzylamino)-2-azabicyclo[2.2.1]hepane-3(S)-isopropylmethanol
Alternate Name(s) (1S,3R,4R)-2-(Benzyl)-2-azabicyclo[2.2.1]hepane-3(S)-isopropylmethanol
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H25NO
InChI InChI=1S/C17H25NO/c1-12(2)17(19)16-14-8-9-15(10-14)18(16)11-13-6-4-3-5-7-13/h3-7,12,14-17,19H,8-11H2,1-2H3/t14-,15+,16+,17+/m1/s1
InChIKey FEYYBOXHOAZXFW-QZWWFDLISA-N
Molecular Weight 259.393 g/mol
SMILES O[C@]([C@]1(N([C@@]2(C[C@]1(CC2)[H])[H])Cc1ccccc1)[H])(C(C)C)[H]
SPLASH splash10-000i-0900000000-b410c48b00dfb9477450
Source of Spectrum QE-5-1697-7
Wiley ID 844198