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3-Isopropyl[3]manxine-6,9-diol
SpectraBase Compound ID Ew2I01m0DWj
InChI InChI=1S/C13H25NO2/c1-9(2)11-7-10-3-4-13(16)14(8-11)6-5-12(10)15/h9-13,15-16H,3-8H2,1-2H3/t10-,11?,12?,13?/m1/s1
InChIKey XWFPGSWJIVVKBR-PEWWYSNMSA-N
Mol Weight 227.35 g/mol
Molecular Formula C13H25NO2
Exact Mass 227.188529 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7LAx6VDF22m
Name 3-Isopropyl[3]manxine-6,9-diol
CAS Registry Number 80301-21-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H25NO2
InChI InChI=1S/C13H25NO2/c1-9(2)11-7-10-3-4-13(16)14(8-11)6-5-12(10)15/h9-13,15-16H,3-8H2,1-2H3/t10-,11?,12?,13?/m1/s1
InChIKey XWFPGSWJIVVKBR-PEWWYSNMSA-N
Molecular Weight 227.348 g/mol
SMILES OC1[C@]2(CC(CN(C(CC2)O)CC1)C(C)C)[H]
SPLASH splash10-00di-9010000000-e53db55da6bf2091a97c
Source of Spectrum J-47-862-0
Synonyms 10-isopropyl-1-azabicyclo[3.3.3]undecane-2,6-diol
Wiley ID 1228658