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4,7-Methano-1,3-dioxolo[4,5-d][1,2]oxazepin-8-ol, hexahydro-2,2,5-trimethyl-, acetate (ester), [3aR-(3a.alpha.,4.beta.,7.beta.,8.alpha.,8a.alpha.)]-
SpectraBase Compound ID 6UChLcRBu3A
InChI InChI=1S/C12H19NO5/c1-6(14)15-10-8-5-7(13(4)18-8)9-11(10)17-12(2,3)16-9/h7-11H,5H2,1-4H3/t7-,8+,9+,10+,11+/m1/s1
InChIKey YCBQPROQRLQCLY-NMUGVGKYSA-N
Mol Weight 257.29 g/mol
Molecular Formula C12H19NO5
Exact Mass 257.126323 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9T9xfNmlhjG
Name 4,7-Methano-1,3-dioxolo[4,5-d][1,2]oxazepin-8-ol, hexahydro-2,2,5-trimethyl-, acetate (ester), [3aR-(3a.alpha.,4.beta.,7.beta.,8.alpha.,8a.alpha.)]-
CAS Registry Number 73111-67-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H19NO5
InChI InChI=1S/C12H19NO5/c1-6(14)15-10-8-5-7(13(4)18-8)9-11(10)17-12(2,3)16-9/h7-11H,5H2,1-4H3/t7-,8+,9+,10+,11+/m1/s1
InChIKey YCBQPROQRLQCLY-NMUGVGKYSA-N
Molecular Weight 257.286 g/mol
SMILES [C@@]12([C@@]([C@@](OC(=O)C)([C@@]3(C[C@]2(N(O3)C)[H])[H])[H])(OC(O1)(C)C)[H])[H]
SPLASH splash10-0536-9110000000-602dc1eab2db03b80918
Source of Spectrum H-62-2409-0
Synonyms (1R,2S,6S,7R,8S)-4,4,10-trimethyl-3,5,9-trioxa-10-azatricyclo[6.2.1.0(2,6)]undec-7-yl acetate 4-O-Acetyl-1',3-anhydro-1,2-dideoxy-1-(hydroxymethylamino)-5,6-O-isopropylidene-L-allo-inositol
Wiley ID 103111