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

*Links on SpectraBase are not permalinks.

2-Pivaloylamino-9-ethylthio-5,6,7,8,9,10-hexahydro-5,9-methanopyrimido[4,5-b]azocin-4(3H)-one

View entire compound with spectra: 1 MS (GC)

2-Pivaloylamino-9-ethylthio-5,6,7,8,9,10-hexahydro-5,9-methanopyrimido[4,5-b]azocin-4(3H)-one
SpectraBase Compound ID H2FRvxLOZUz
InChI InChI=1S/C17H26N4O2S/c1-5-24-17-8-6-7-10(9-17)11-12(21-17)18-15(19-13(11)22)20-14(23)16(2,3)4/h10H,5-9H2,1-4H3,(H3,18,19,20,21,22,23)
InChIKey FUGZSOREZBUEOK-UHFFFAOYSA-N
Mol Weight 350.48 g/mol
Molecular Formula C17H26N4O2S
Exact Mass 350.177647 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 KSzsoI8ZDzv
Name 2-Pivaloylamino-9-ethylthio-5,6,7,8,9,10-hexahydro-5,9-methanopyrimido[4,5-b]azocin-4(3H)-one
Alternate Name(s) N-[9-(ethylsulfanyl)-3-oxo-4,6,8-triazatricyclo[7.3.1.0(2,7)]trideca-2(7),5-dien-5-yl]-2,2-dimethylpropanamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H26N4O2S
InChI InChI=1S/C17H26N4O2S/c1-5-24-17-8-6-7-10(9-17)11-12(21-17)18-15(19-13(11)22)20-14(23)16(2,3)4/h10H,5-9H2,1-4H3,(H3,18,19,20,21,22,23)
InChIKey FUGZSOREZBUEOK-UHFFFAOYSA-N
Molecular Weight 350.481 g/mol
SMILES N(C1=NC2=C(C(N1)=O)C1CCCC(N2)(C1)SCC)C(C(C)(C)C)=O
SPLASH splash10-000i-0098000000-4c87aa51002b5a8b8fbd
Source of Spectrum F-54-9516-17
Wiley ID 808270