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

*Links on SpectraBase are not permalinks.
(+-)-(6aS,8S)-2-chloro-5,6,6a,7,8,10a-hexahydro-5-methyl-8,10a-epoxypyrimido[5,4-c]isoquinoline
SpectraBase Compound ID 7XhMr5g8R1a
InChI InChI=1S/C12H12ClN3O/c1-16-6-7-4-8-2-3-12(7,17-8)10-9(16)5-14-11(13)15-10/h2-3,5,7-8H,4,6H2,1H3/t7-,8+,12?/m0/s1
InChIKey QVOUGWVOEMFOIY-HTVOERESSA-N
Mol Weight 249.7 g/mol
Molecular Formula C12H12ClN3O
Exact Mass 249.06689 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 9y6b6xuu0AT
Name (+-)-(6aS,8S)-2-chloro-5,6,6a,7,8,10a-hexahydro-5-methyl-8,10a-epoxypyrimido[5,4-c]isoquinoline
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H12ClN3O
InChI InChI=1S/C12H12ClN3O/c1-16-6-7-4-8-2-3-12(7,17-8)10-9(16)5-14-11(13)15-10/h2-3,5,7-8H,4,6H2,1H3/t7-,8+,12?/m0/s1
InChIKey QVOUGWVOEMFOIY-HTVOERESSA-N
Molecular Weight 249.701 g/mol
SMILES C123c4c(cnc(n4)Cl)N(C[C@@]1(C[C@](O2)(C=C3)[H])[H])C
SPLASH splash10-0592-0090000000-2b1ba041412db6f6d27e
Source of Spectrum F-68-1882-13k
Wiley ID 1707853