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

*Links on SpectraBase are not permalinks.
(1S,5R,6R)-4-keto-7,8-dioxa-3-azabicyclo[3.2.1]octane-6-carboxylic acid methyl ester
SpectraBase Compound ID DbMMdNlnbid
InChI InChI=1S/C7H9NO5/c1-11-7(10)5-4-6(9)8-2-3(12-4)13-5/h3-5H,2H2,1H3,(H,8,9)/t3-,4+,5+/m0/s1
InChIKey ROVNWXFULCGWSK-VPENINKCSA-N
Mol Weight 187.15 g/mol
Molecular Formula C7H9NO5
Exact Mass 187.048072 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 3HYHLzy8T9G
Name (1S,5R,6R)-4-keto-7,8-dioxa-3-azabicyclo[3.2.1]octane-6-carboxylic acid methyl ester
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H9NO5
InChI InChI=1S/C7H9NO5/c1-11-7(10)5-4-6(9)8-2-3(12-4)13-5/h3-5H,2H2,1H3,(H,8,9)/t3-,4+,5+/m0/s1
InChIKey ROVNWXFULCGWSK-VPENINKCSA-N
Molecular Weight 187.151 g/mol
SMILES N1C[C@@]2(O[C@]([C@](C1=O)(O2)[H])(C(=O)OC)[H])[H]
SPLASH splash10-00di-9000000000-608168fe733467ec6666
Source of Spectrum J-64-7360-13
Synonyms (1S,5R,6R)-4-oxo-7,8-dioxa-3-azabicyclo[3.2.1]octane-6-carboxylic acid methyl ester methyl (1S,5R,6R)-4-oxidanylidene-7,8-dioxa-3-azabicyclo[3.2.1]octane-6-carboxylate methyl (1S,5R,6R)-4-oxo-7,8-dioxa-3-azabicyclo[3.2.1]octane-6-carboxylate
Wiley ID 1531115