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(1S,5S,7S)-3-[(1S,R)-1-Ethyl-2-methyl-2-propenyl-1-oxy]-7-endo-hydroxymethyl-6,8-dioxa-3-azabicyclo[3.2.1]octane
SpectraBase Compound ID 1xQbSMrmU29
InChI InChI=1S/C12H21NO4/c1-4-9(8(2)3)17-13-5-10-11(7-14)16-12(6-13)15-10/h9-12,14H,2,4-7H2,1,3H3/t9?,10-,11-,12-/m0/s1
InChIKey RIDWYAIHVPHDFU-LLTYBXMGSA-N
Mol Weight 243.3 g/mol
Molecular Formula C12H21NO4
Exact Mass 243.147058 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LZ2LS4KqyFH
Name (1S,5S,7S)-3-[(1S,R)-1-Ethyl-2-methyl-2-propenyl-1-oxy]-7-endo-hydroxymethyl-6,8-dioxa-3-azabicyclo[3.2.1]octane
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H21NO4
InChI InChI=1S/C12H21NO4/c1-4-9(8(2)3)17-13-5-10-11(7-14)16-12(6-13)15-10/h9-12,14H,2,4-7H2,1,3H3/t9?,10-,11-,12-/m0/s1
InChIKey RIDWYAIHVPHDFU-LLTYBXMGSA-N
Molecular Weight 243.303 g/mol
SMILES OC[C@]1([C@@]2(CN(C[C@](O1)(O2)[H])OC(C(=C)C)CC)[H])[H]
SPLASH splash10-001i-9000000000-b8f6520a89566d95d457
Source of Spectrum QC-11-4236-33
Synonyms {(1S,5S,7S)-3-[(1-ethyl-2-methyl-2-propenyl)oxy]-6,8-dioxa-3-azabicyclo[3.2.1]oct-7-yl}methanol
Wiley ID 860172