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

*Links on SpectraBase are not permalinks.
Ethyl[(1S,2S,3S,4R)-2,4-Diformyl-3-(2-nitrophenyl)cyclohexyl]acetate
SpectraBase Compound ID 2kU5mHB3e45
InChI InChI=1S/C18H21NO6/c1-2-25-17(22)9-12-7-8-13(10-20)18(15(12)11-21)14-5-3-4-6-16(14)19(23)24/h3-6,10-13,15,18H,2,7-9H2,1H3/t12-,13-,15-,18+/m0/s1
InChIKey ASDNBDWIXHFWJE-BWQRHGBYSA-N
Mol Weight 347.37 g/mol
Molecular Formula C18H21NO6
Exact Mass 347.136887 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 52hpcH5zZ0Y
Name Ethyl[(1S,2S,3S,4R)-2,4-Diformyl-3-(2-nitrophenyl)cyclohexyl]acetate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H21NO6
InChI InChI=1S/C18H21NO6/c1-2-25-17(22)9-12-7-8-13(10-20)18(15(12)11-21)14-5-3-4-6-16(14)19(23)24/h3-6,10-13,15,18H,2,7-9H2,1H3/t12-,13-,15-,18+/m0/s1
InChIKey ASDNBDWIXHFWJE-BWQRHGBYSA-N
Molecular Weight 347.367 g/mol
SMILES c1(N(=O)=O)c([C@@]2([C@]([C@](CC(=O)OCC)(CC[C@]2(C=O)[H])[H])(C=O)[H])[H])cccc1
SPLASH splash10-05o1-0961000000-61a6abd18a817af5f8a2
Source of Spectrum F4-43-1891-3f
Wiley ID 1675688