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2,8,11-Trimethyl-5,11-methano-6H,12H-tetrahydrodibenzo[b,f][1,5]diazocine-11-ium iodide
SpectraBase Compound ID 4g4qH1mMD0V
InChI InChI=1S/C18H21N2.HI/c1-13-4-6-17-16(9-13)11-20(3)12-19(17)10-15-8-14(2)5-7-18(15)20;/h4-9H,10-12H2,1-3H3;1H/q+1;/p-1
InChIKey ZKOXXZOEQOAWKH-UHFFFAOYSA-M
Mol Weight 392.28 g/mol
Molecular Formula C18H21IN2
Exact Mass 392.074944 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID J3nvoy53gcI
Name 2,8,11-Trimethyl-5,11-methano-6H,12H-tetrahydrodibenzo[b,f][1,5]diazocine-11-ium iodide
Alternate Name(s) 1,5,13-trimethyl-9-aza-1-azoniatetracyclo[7.7.1.0(2,7).0(10,15)]heptadeca-2,4,6,10,12,14-hexaene iodide
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Formula C18H21IN2
InChI InChI=1S/C18H21N2.HI/c1-13-4-6-17-16(9-13)11-20(3)12-19(17)10-15-8-14(2)5-7-18(15)20;/h4-9H,10-12H2,1-3H3;1H/q+1;/p-1
InChIKey ZKOXXZOEQOAWKH-UHFFFAOYSA-M
Molecular Weight 392.284 g/mol
SMILES [I-].C1[N+]2(Cc3c(N1Cc1c2ccc(C)c1)ccc(c3)C)C
SPLASH splash10-0udm-0290000000-fc569605696ab4ea21f5
Source of Spectrum KC-0-48-2
Wiley ID 820678