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1.alpha.Chloro-2.alpha.,3.alpha.-epoxy-4.beta.-[(benzyloxycarbonyl)amino]cycloheptane
SpectraBase Compound ID Bykbs5WsOmC
InChI InChI=1S/C15H18ClNO3/c16-11-7-4-8-12(14-13(11)20-14)17-15(18)19-9-10-5-2-1-3-6-10/h1-3,5-6,11-14H,4,7-9H2,(H,17,18)/t11-,12-,13-,14+/m1/s1
InChIKey IPFWQZYCUAMBKX-SYQHCUMBSA-N
Mol Weight 295.77 g/mol
Molecular Formula C15H18ClNO3
Exact Mass 295.097521 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ICvRojNMqCU
Name 1.alpha.Chloro-2.alpha.,3.alpha.-epoxy-4.beta.-[(benzyloxycarbonyl)amino]cycloheptane
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H18ClNO3
InChI InChI=1S/C15H18ClNO3/c16-11-7-4-8-12(14-13(11)20-14)17-15(18)19-9-10-5-2-1-3-6-10/h1-3,5-6,11-14H,4,7-9H2,(H,17,18)/t11-,12-,13-,14+/m1/s1
InChIKey IPFWQZYCUAMBKX-SYQHCUMBSA-N
Molecular Weight 295.766 g/mol
SMILES N(C(=O)OCc1ccccc1)[C@]1([C@@]2(O[C@@]2([C@](Cl)(CCC1)[H])[H])[H])[H]
SPLASH splash10-052f-8940000000-51f2fa6e748991309621
Source of Spectrum F-52-11971-17
Synonyms benzyl (1S,2R,6R,7S)-6-chloro-8-oxabicyclo[5.1.0]oct-2-ylcarbamate
Wiley ID 798618