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(R)-11a-methyl-8,8-dipropyl-8,9,10,11a-tetrahydro-7H-benzo[a]carbazole
SpectraBase Compound ID KC2qbFR699w
InChI InChI=1S/C23H29N/c1-4-13-23(14-5-2)15-12-21-18(16-23)20-11-10-17-8-6-7-9-19(17)22(20,3)24-21/h6-11H,4-5,12-16H2,1-3H3/t22-/m1/s1
InChIKey SRVGNHKRGYNMPS-JOCHJYFZSA-N
Mol Weight 319.49 g/mol
Molecular Formula C23H29N
Exact Mass 319.23 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID k7AqrbFwsv
Name (R)-11a-methyl-8,8-dipropyl-8,9,10,11a-tetrahydro-7H-benzo[a]carbazole
Appearance Yellow oil
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Exact Mass 319.229999938 u
Formula C23H29N
InChI InChI=1S/C23H29N/c1-4-13-23(14-5-2)15-12-21-18(16-23)20-11-10-17-8-6-7-9-19(17)22(20,3)24-21/h6-11H,4-5,12-16H2,1-3H3/t22-/m1/s1
InChIKey SRVGNHKRGYNMPS-JOCHJYFZSA-N
Ionization Type EI
Literature Reference DOI 10.1002/anie.201602932
Molecular Weight 319.492 g/mol
Optical Rotation [a]D25 = +600 (c = 0.9, CH2Cl2)
Quality 40
Reported Formula C23H29N
SMILES C1=CC2=C(C=C1)C=CC=1[C@@]2(N=C2C1CC(CC2)(CCC)CCC)C
SPLASH splash10-00kf-0938000000-21573ce7af0e238e6d5d
Sample Comments er = 92.5:7.5
Source of Spectrum ACI-55-SM13-5c (DOI: 10.1002/anie.201602932)
Wiley ID 1904478