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8-Ethyl-1-(3-bromopropyl)-1,3,4,9-tetrahydropyrano[3,4-b]indol-1-carbonitrile
SpectraBase Compound ID 8koV6D6Co7B
InChI InChI=1S/C17H19BrN2O/c1-2-12-5-3-6-13-14-7-10-21-17(11-19,8-4-9-18)16(14)20-15(12)13/h3,5-6,20H,2,4,7-10H2,1H3
InChIKey IKAUDDRULPXPKR-UHFFFAOYSA-N
Mol Weight 347.26 g/mol
Molecular Formula C17H19BrN2O
Exact Mass 346.068076 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DuR3IRYOSDq
Name 8-Ethyl-1-(3-bromopropyl)-1,3,4,9-tetrahydropyrano[3,4-b]indol-1-carbonitrile
Comments Less than 3 mono-isotopic peaks
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Formula C17H19BrN2O
InChI InChI=1S/C17H19BrN2O/c1-2-12-5-3-6-13-14-7-10-21-17(11-19,8-4-9-18)16(14)20-15(12)13/h3,5-6,20H,2,4,7-10H2,1H3
InChIKey IKAUDDRULPXPKR-UHFFFAOYSA-N
Molecular Weight 347.256 g/mol
SMILES [nH]1c2c(cccc2c2c1C(OCC2)(C#N)CCCBr)CC
SPLASH splash10-004i-0094000000-0045c5c0b82423c3cc35
Source of Spectrum O1-60-1109-21
Synonyms 1-(3-bromopropyl)-8-ethyl-1,3,4,9-tetrahydropyrano[3,4-b]indole-1-carbonitrile
Wiley ID 1592032