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1-Azatricyclo[3.3.1.13,7]decane-3-carbonitrile, 5,7-dimethyl-4,6-dioxo-
SpectraBase Compound ID GiipNePmbVI
InChI InChI=1S/C12H14N2O2/c1-10-3-12(4-13)7-14(5-10)6-11(2,8(10)15)9(12)16/h3,5-7H2,1-2H3
InChIKey HVGWCCZQMVUPKM-UHFFFAOYSA-N
Mol Weight 218.26 g/mol
Molecular Formula C12H14N2O2
Exact Mass 218.105528 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6q0R93O0rmb
Name 1-Azatricyclo[3.3.1.13,7]decane-3-carbonitrile, 5,7-dimethyl-4,6-dioxo-
CAS Registry Number 101074-46-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H14N2O2
InChI InChI=1S/C12H14N2O2/c1-10-3-12(4-13)7-14(5-10)6-11(2,8(10)15)9(12)16/h3,5-7H2,1-2H3
InChIKey HVGWCCZQMVUPKM-UHFFFAOYSA-N
Molecular Weight 218.256 g/mol
SMILES C12(C(C3(C#N)CN(C2)CC(C1=O)(C3)C)=O)C
SPLASH splash10-014l-9130000000-a1e981089daf0e4edb55
Source of Spectrum K-118-4085-17
Synonyms 5,7-Dimethyl-4,6-dioxo-1-azaadamantan-3-carbonitril 5,7-Dimethyl-4,6-dioxo-1-azatricyclo[3.3.1.1(3,7)]decane-3-carbonitrile
Wiley ID 1217544