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7,8,9,10-Tetrahydro-9-methyl-9-propyl[1,4]diazepino[1,2,3-g,h]purine
SpectraBase Compound ID 5i9cAt9AS3k
InChI InChI=1S/C12H17N5/c1-3-4-12(2)5-6-17-8-15-10-9(17)11(16-12)14-7-13-10/h7-8H,3-6H2,1-2H3,(H,13,14,16)
InChIKey SCAHWNJSKCWXTL-UHFFFAOYSA-N
Mol Weight 231.3 g/mol
Molecular Formula C12H17N5
Exact Mass 231.148396 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 38FKkYVlaFW
Name 7,8,9,10-Tetrahydro-9-methyl-9-propyl[1,4]diazepino[1,2,3-g,h]purine
Comments Less than 3 mono-isotopic peaks
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Formula C12H17N5
InChI InChI=1S/C12H17N5/c1-3-4-12(2)5-6-17-8-15-10-9(17)11(16-12)14-7-13-10/h7-8H,3-6H2,1-2H3,(H,13,14,16)
InChIKey SCAHWNJSKCWXTL-UHFFFAOYSA-N
Molecular Weight 231.303 g/mol
SMILES N1C(CC[n]2c3c1ncnc3nc2)(CCC)C
SPLASH splash10-000i-0910000000-01b5be7069c02955c694
Source of Spectrum F-70-205-19
Wiley ID 1596078