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

*Links on SpectraBase are not permalinks.
N-Methyl-6,7,8,9,10,11-hexahydro-5H-5,9:7,11-dimethano[1,2,4]triazolo[4,3-a]azocin-3-one
SpectraBase Compound ID FR5dT9yLyA9
InChI InChI=1S/C12H17N3O/c1-14-12(16)15-10-5-7-2-8(6-10)4-9(3-7)11(15)13-14/h7-10H,2-6H2,1H3/t7-,8+,9-,10+
InChIKey ULBVIBMTTIPELV-YNFQOJQRSA-N
Mol Weight 219.29 g/mol
Molecular Formula C12H17N3O
Exact Mass 219.137162 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 9QgUO8InxU1
Name N-Methyl-6,7,8,9,10,11-hexahydro-5H-5,9:7,11-dimethano[1,2,4]triazolo[4,3-a]azocin-3-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H17N3O
InChI InChI=1S/C12H17N3O/c1-14-12(16)15-10-5-7-2-8(6-10)4-9(3-7)11(15)13-14/h7-10H,2-6H2,1H3/t7-,8+,9-,10+
InChIKey ULBVIBMTTIPELV-YNFQOJQRSA-N
Molecular Weight 219.288 g/mol
SMILES C1=2N(C(N(N2)C)=O)[C@@]2(C[C@]3(C[C@]1(C[C@@](C2)(C3)[H])[H])[H])[H]
SPLASH splash10-016r-3290000000-51ddb7dafe0c20545ebd
Source of Spectrum HC-48-1520-5a
Synonyms (7R,9S)-2-methyl-6,7,8,9,10,11-hexahydro-2H-5,9:7,11-dimethano[1,2,4]triazolo[4,3-a]azonin-3(5H)-one
Wiley ID 1739442