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(1S,9R)-2-((tert-butylamino)methyl)-6,10,10-trimethylbicyclo[7.2.0]undecane-2,5,6-triol
SpectraBase Compound ID LLu1FSbdcbD
InChI InChI=1S/C19H37NO3/c1-16(2,3)20-12-19(23)10-8-15(21)18(6,22)9-7-13-14(19)11-17(13,4)5/h13-15,20-23H,7-12H2,1-6H3/t13-,14+,15?,18?,19?/m1/s1
InChIKey VIWZPJPPARTMGH-NQHLVNEUSA-N
Mol Weight 327.5 g/mol
Molecular Formula C19H37NO3
Exact Mass 327.277344 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HhE9lVgZjdp
Name (1S,9R)-2-((tert-butylamino)methyl)-6,10,10-trimethylbicyclo[7.2.0]undecane-2,5,6-triol
Classification Sesquiterpenoids
Copyright Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved.
Exact Mass 327.277344052 u
Formula C19H37NO3
InChI InChI=1S/C19H37NO3/c1-16(2,3)20-12-19(23)10-8-15(21)18(6,22)9-7-13-14(19)11-17(13,4)5/h13-15,20-23H,7-12H2,1-6H3/t13-,14+,15?,18?,19?/m1/s1
InChIKey VIWZPJPPARTMGH-NQHLVNEUSA-N
Molecular Weight 327.509 g/mol
Number of Peaks 24
SMILES OC1(C(CCC([C@@]2([C@@](CC1)(C(C2)(C)C)[H])[H])(CNC(C)(C)C)O)O)C
SPLASH splash10-000i-9000000000-a2d7e92e4594356f29e0
Source of Spectrum FF-5-16-16_4 (DOI: 10.1002/ffj.2730050102)
Wiley ID 1801201