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[(3aR,5S,6R,6aR)-2,2-dimethyl-6-(oxidanylamino)-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-5-yl]methyl benzoate
SpectraBase Compound ID 8bRFp9kzMuq
InChI InChI=1S/C15H19NO6/c1-15(2)21-12-11(16-18)10(20-14(12)22-15)8-19-13(17)9-6-4-3-5-7-9/h3-7,10-12,14,16,18H,8H2,1-2H3/t10-,11-,12-,14-/m1/s1
InChIKey RUDPCEWYAIZTRJ-HKUMRIAESA-N
Mol Weight 309.32 g/mol
Molecular Formula C15H19NO6
Exact Mass 309.121237 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9npSx2jv0Ay
Name [(3aR,5S,6R,6aR)-2,2-dimethyl-6-(oxidanylamino)-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-5-yl]methyl benzoate
CAS Registry Number 83905-12-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H19NO6
InChI InChI=1S/C15H19NO6/c1-15(2)21-12-11(16-18)10(20-14(12)22-15)8-19-13(17)9-6-4-3-5-7-9/h3-7,10-12,14,16,18H,8H2,1-2H3/t10-,11-,12-,14-/m1/s1
InChIKey RUDPCEWYAIZTRJ-HKUMRIAESA-N
Molecular Weight 309.318 g/mol
SMILES N([C@]1([C@@]2([C@@](OC(O2)(C)C)(O[C@@]1(COC(=O)c1ccccc1)[H])[H])[H])[H])O
SPLASH splash10-052f-0910000000-09b5ac224fac173cfcac
Source of Spectrum H-69-1134-10
Synonyms [(3aR,5S,6R,6aR)-6-(hydroxyamino)-2,2-dimethyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-5-yl]methyl benzoate
Wiley ID 1310551