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(+-)-(6aR,8S)-5-Allyl-2-chloro-5,6,6a,7,8,10a-hexahydro-8,10a-epoxypyrimido[5,4-c]isoquinoline
SpectraBase Compound ID 9PmroyGrnos
InChI InChI=1S/C14H14ClN3O/c1-2-5-18-8-9-6-10-3-4-14(9,19-10)12-11(18)7-16-13(15)17-12/h2-4,7,9-10H,1,5-6,8H2/t9-,10-,14?/m1/s1
InChIKey NLUQVKVICPLBQA-QYFJWPRKSA-N
Mol Weight 275.74 g/mol
Molecular Formula C14H14ClN3O
Exact Mass 275.08254 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID G2gehZM1FDM
Name (+-)-(6aR,8S)-5-Allyl-2-chloro-5,6,6a,7,8,10a-hexahydro-8,10a-epoxypyrimido[5,4-c]isoquinoline
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H14ClN3O
InChI InChI=1S/C14H14ClN3O/c1-2-5-18-8-9-6-10-3-4-14(9,19-10)12-11(18)7-16-13(15)17-12/h2-4,7,9-10H,1,5-6,8H2/t9-,10-,14?/m1/s1
InChIKey NLUQVKVICPLBQA-QYFJWPRKSA-N
Molecular Weight 275.739 g/mol
SMILES C123c4c(cnc(n4)Cl)N(C[C@]1(C[C@](O2)(C=C3)[H])[H])CC=C
SPLASH splash10-004i-0090000000-b7a5f56d57fba5bb46ca
Source of Spectrum F-68-1882-14j
Wiley ID 1707854