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3-Oxa-6-azatricyclo[3.2.0.0(2,4)]heptane-6-acetic acid, 7-oxo-,phenylmethyl ester, (1.alpha.,2.beta.,4.beta.,5.alpha.)-
SpectraBase Compound ID 3gQRpB3Ot12
InChI InChI=1S/C14H13NO4/c16-9(18-7-8-4-2-1-3-5-8)6-15-11-10(14(15)17)12-13(11)19-12/h1-5,10-13H,6-7H2/t10-,11+,12+,13-/m1/s1
InChIKey CLOBNKFNQGIXCI-MROQNXINSA-N
Mol Weight 259.26 g/mol
Molecular Formula C14H13NO4
Exact Mass 259.084458 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 74iNqCGxtS1
Name 3-Oxa-6-azatricyclo[3.2.0.0(2,4)]heptane-6-acetic acid, 7-oxo-,phenylmethyl ester, (1.alpha.,2.beta.,4.beta.,5.alpha.)-
CAS Registry Number 80056-46-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H13NO4
InChI InChI=1S/C14H13NO4/c16-9(18-7-8-4-2-1-3-5-8)6-15-11-10(14(15)17)12-13(11)19-12/h1-5,10-13H,6-7H2/t10-,11+,12+,13-/m1/s1
InChIKey CLOBNKFNQGIXCI-MROQNXINSA-N
Molecular Weight 259.261 g/mol
SMILES [C@@]12([C@@]([H])(O2)[C@]2([C@@]1(N(C2=O)CC(=O)OCc1ccccc1)[H])[H])[H]
SPLASH splash10-00kf-9000000000-bd77079444a7f2ce9892
Source of Spectrum KC-1981-2622-0
Synonyms benzyl[(1R,2S,4R,5S)-7-oxo-3-oxa-6-azatricyclo[3.2.0.0(2,4)]hept-6-yl]acetate N-Benzyloxycarbonylmethylene-3-oxo-2-azabicyclo[2.2.0]hex-5-ene 5,6-epoxide
Wiley ID 1262685