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

*Links on SpectraBase are not permalinks.
4-Acetamido-2,6,13-trioxapentacyclo[5.5.1.0(3,11).0(5,9).0(8,12)]tridecane
SpectraBase Compound ID JKJcXYj9Gnu
InChI InChI=1S/C11H13NO4/c1-3(13)12-8-4-2-5-7-6(4)10(14-8)16-11(7)15-9(5)12/h4-11H,2H2,1H3/t4-,5+,6-,7+,8+,9-,10+,11-
InChIKey KIOYFXNVQBUDHB-DNXKPUGKSA-N
Mol Weight 223.23 g/mol
Molecular Formula C11H13NO4
Exact Mass 223.084458 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 LRHiicysb8T
Name 4-Acetamido-2,6,13-trioxapentacyclo[5.5.1.0(3,11).0(5,9).0(8,12)]tridecane
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H13NO4
InChI InChI=1S/C11H13NO4/c1-3(13)12-8-4-2-5-7-6(4)10(14-8)16-11(7)15-9(5)12/h4-11H,2H2,1H3/t4-,5+,6-,7+,8+,9-,10+,11-
InChIKey KIOYFXNVQBUDHB-DNXKPUGKSA-N
Molecular Weight 223.228 g/mol
SMILES [C@]12(N([C@@]3(O[C@]4([C@]5([C@@]3(C[C@@]1([C@]5([C@@](O2)(O4)[H])[H])[H])[H])[H])[H])[H])C(=O)C)[H]
SPLASH splash10-001i-0910000000-12321341741b0c1ff29b
Source of Spectrum F-54-5979-12
Synonyms 8-acetyl-10,12,13-trioxa-8-azapentacyclo[5.5.1.0(2,6).0(3,11).0(4,9)]tridecane
Wiley ID 807053