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

*Links on SpectraBase are not permalinks.
(2R,3S)-2,3-Epoxy-4-phenylbutyl 3,5-dinitrobenzoate
SpectraBase Compound ID J3UUmH95nuF
InChI InChI=1S/C17H14N2O7/c20-17(12-7-13(18(21)22)9-14(8-12)19(23)24)25-10-16-15(26-16)6-11-4-2-1-3-5-11/h1-5,7-9,15-16H,6,10H2/t15-,16+/m0/s1
InChIKey VTGSUWPBZXZCPN-JKSUJKDBSA-N
Mol Weight 358.31 g/mol
Molecular Formula C17H14N2O7
Exact Mass 358.080101 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 CBTSnILtta5
Name (2R,3S)-2,3-Epoxy-4-phenylbutyl 3,5-dinitrobenzoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H14N2O7
InChI InChI=1S/C17H14N2O7/c20-17(12-7-13(18(21)22)9-14(8-12)19(23)24)25-10-16-15(26-16)6-11-4-2-1-3-5-11/h1-5,7-9,15-16H,6,10H2/t15-,16+/m0/s1
InChIKey VTGSUWPBZXZCPN-JKSUJKDBSA-N
Molecular Weight 358.306 g/mol
SMILES [C@]1(O[C@]1(Cc1ccccc1)[H])(COC(c1cc(N(=O)=O)cc(N(=O)=O)c1)=O)[H]
SPLASH splash10-0005-4900000000-b20bdf4d5b6dcb8755a7
Source of Spectrum E2-46-1817-6
Synonyms (2S,3S)-2,3-Epoxy-4-phenylbutyl 3,5-dinitrobenzoate [(2R,3S)-3-benzyloxiranyl]methyl 3,5-dinitrobenzoate
Wiley ID 1554613