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(1R,2S,3R,6S)-6-(N-carbomethoxyamino) 1,2-O-isopropylidenecyclohex-4-ene-1,2,3-triol
SpectraBase Compound ID Lu5WxOOF6RD
InChI InChI=1S/C11H17NO5/c1-11(2)16-8-6(12-10(14)15-3)4-5-7(13)9(8)17-11/h4-9,13H,1-3H3,(H,12,14)/t6-,7+,8+,9-/m0/s1
InChIKey XVENAHYKOLIPGQ-KDXUFGMBSA-N
Mol Weight 243.26 g/mol
Molecular Formula C11H17NO5
Exact Mass 243.110673 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6HAXAhKI6Dn
Name (1R,2S,3R,6S)-6-(N-carbomethoxyamino) 1,2-O-isopropylidenecyclohex-4-ene-1,2,3-triol
Alternate Name(s) Methyl ((3aR,4S,7R,7aS)-7-hydroxy-2,2-dimethyl-3a,4,7,7a-tetrahydrobenzo[d][1,3]dioxol-4-yl)carbamate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H17NO5
InChI InChI=1S/C11H17NO5/c1-11(2)16-8-6(12-10(14)15-3)4-5-7(13)9(8)17-11/h4-9,13H,1-3H3,(H,12,14)/t6-,7+,8+,9-/m0/s1
InChIKey XVENAHYKOLIPGQ-KDXUFGMBSA-N
Literature Reference DOI 10.1002/rcm.2865
Molecular Weight 243.259 g/mol
SMILES N([C@]1(C=C[C@]([C@]2([C@@]1(OC(O2)(C)C)[H])[H])(O)[H])[H])C(=O)OC
SPLASH splash10-0536-5900000000-6129a9be6a74749bee4d
Source of Spectrum RCM-21-581-1
Wiley ID 1814402