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3-(8-Methyl-1,2,3a,4,5,6-hexahydro-3H-pyrazino[3,2,1-jk]carbazol-3-yl)propanenitrile
SpectraBase Compound ID 7084KAQ96Vi
InChI InChI=1S/C18H21N3/c1-13-6-7-16-15(12-13)14-4-2-5-17-18(14)21(16)11-10-20(17)9-3-8-19/h6-7,12,17H,2-5,9-11H2,1H3
InChIKey HWJBOELNKXRKJA-UHFFFAOYSA-N
Mol Weight 279.39 g/mol
Molecular Formula C18H21N3
Exact Mass 279.173548 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B3hFXbJgpkG
Name 3-(8-Methyl-1,2,3a,4,5,6-hexahydro-3H-pyrazino[3,2,1-jk]carbazol-3-yl)propanenitrile
CAS Registry Number 329070-85-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H21N3
InChI InChI=1S/C18H21N3/c1-13-6-7-16-15(12-13)14-4-2-5-17-18(14)21(16)11-10-20(17)9-3-8-19/h6-7,12,17H,2-5,9-11H2,1H3
InChIKey HWJBOELNKXRKJA-UHFFFAOYSA-N
Molecular Weight 279.387 g/mol
SMILES Cc1ccc2c(c1)c1c3[n]2CCN(CCC#N)C3CCC1
SPLASH splash10-0006-9410000000-6345a046ad3d8352e16c
Source of Spectrum AD-0-2532-0
Synonyms 3-(8-Methyl-2,3,3a,4,5,6-hexahydro-1H-pyrazino[3,2,1-jk]carbazol-3-yl)propionitrile
Wiley ID 1422068