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(3as,5R,5ar,8ar,8bs)-5-Benzyloxy-1,7,7-trimethyl-octahydro-2,6,8-trioxa-1-aza-as-indacene

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(3as,5R,5ar,8ar,8bs)-5-Benzyloxy-1,7,7-trimethyl-octahydro-2,6,8-trioxa-1-aza-as-indacene
SpectraBase Compound ID B04H6bfaNS3
InChI InChI=1S/C18H25NO4/c1-18(2)22-16-14(20-10-12-7-5-4-6-8-12)9-13-11-21-19(3)15(13)17(16)23-18/h4-8,13-17H,9-11H2,1-3H3/t13-,14-,15+,16-,17-/m1/s1
InChIKey IZPASSYPTCZYMO-NQNKBUKLSA-N
Mol Weight 319.4 g/mol
Molecular Formula C18H25NO4
Exact Mass 319.178358 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID H399CSNSPvU
Name (3as,5R,5ar,8ar,8bs)-5-Benzyloxy-1,7,7-trimethyl-octahydro-2,6,8-trioxa-1-aza-as-indacene
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 319.178358285 u
Formula C18H25NO4
InChI InChI=1S/C18H25NO4/c1-18(2)22-16-14(20-10-12-7-5-4-6-8-12)9-13-11-21-19(3)15(13)17(16)23-18/h4-8,13-17H,9-11H2,1-3H3/t13-,14-,15+,16-,17-/m1/s1
InChIKey IZPASSYPTCZYMO-NQNKBUKLSA-N
Molecular Weight 319.401 g/mol
SMILES [C@@]12([C@](OC(O2)(C)C)([C@](OCC2=CC=CC=C2)(C[C@]2([C@@]1(N(OC2)C)[H])[H])[H])[H])[H]