For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
(+/-)-exo-cis-3-(3,5-Dinitrobenzoyl)-5,6-O-isopropylidene-2-oxa-3-azabicyclo[2.2.1]heptane-5,6-diol
SpectraBase Compound ID KZnuyzRcM0o
InChI InChI=1S/C15H15N3O8/c1-15(2)24-12-10-6-11(13(12)25-15)26-16(10)14(19)7-3-8(17(20)21)5-9(4-7)18(22)23/h3-5,10-13H,6H2,1-2H3/t10-,11+,12-,13+/m0/s1
InChIKey QMACPNHGICMHMC-QNWHQSFQSA-N
Mol Weight 365.3 g/mol
Molecular Formula C15H15N3O8
Exact Mass 365.085914 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID FynI4N080UT
Name (+/-)-exo-cis-3-(3,5-Dinitrobenzoyl)-5,6-O-isopropylidene-2-oxa-3-azabicyclo[2.2.1]heptane-5,6-diol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H15N3O8
InChI InChI=1S/C15H15N3O8/c1-15(2)24-12-10-6-11(13(12)25-15)26-16(10)14(19)7-3-8(17(20)21)5-9(4-7)18(22)23/h3-5,10-13H,6H2,1-2H3/t10-,11+,12-,13+/m0/s1
InChIKey QMACPNHGICMHMC-QNWHQSFQSA-N
Literature Reference DOI 10.1002/hlca.19830660702
Molecular Weight 365.298 g/mol
SMILES [C@@]12([C@]3(C[C@@]([C@@]2(OC(O1)(C)C)[H])(N(O3)C(=O)c1cc(cc(c1)[N+]([O-])=O)[N+]([O-])=O)[H])[H])[H]
SPLASH splash10-0005-6902000000-10812f9c034d7c12ada8
Source of Spectrum H-66-1918-4
Synonyms ((3aS,4R,7R,7aS)-2,2-dimethyltetrahydro-6H-4,7-methano[1,3]dioxolo[4,5-d][1,2]oxazin-6-yl)(3,5-dinitrophenyl)methanone
Wiley ID 1794802