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2-Cyclohexen-1-one, 3-[(2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-1-yl)methyl]-
SpectraBase Compound ID L1g399Y7Vp1
InChI InChI=1S/C18H20N2O/c21-13-5-3-4-12(10-13)11-17-18-15(8-9-19-17)14-6-1-2-7-16(14)20-18/h1-2,6-7,10,17,19-20H,3-5,8-9,11H2
InChIKey CQGIVXJBSCQMMG-UHFFFAOYSA-N
Mol Weight 280.37 g/mol
Molecular Formula C18H20N2O
Exact Mass 280.157563 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID qfsz8gvTcI
Name 2-Cyclohexen-1-one, 3-[(2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-1-yl)methyl]-
CAS Registry Number 77828-37-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H20N2O
InChI InChI=1S/C18H20N2O/c21-13-5-3-4-12(10-13)11-17-18-15(8-9-19-17)14-6-1-2-7-16(14)20-18/h1-2,6-7,10,17,19-20H,3-5,8-9,11H2
InChIKey CQGIVXJBSCQMMG-UHFFFAOYSA-N
Molecular Weight 280.371 g/mol
SMILES N1C(c2c(c3ccccc3[nH]2)CC1)CC=1CCCC(C1)=O
SPLASH splash10-00di-0900000000-c1f4688c1dbf8afaad49
Source of Spectrum W5-0-0-0
Synonyms 3-(2,3,4,9-tetrahydro-1H-$b-carbolin-1-ylmethyl)cyclohex-2-en-1-one 3-(2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-1-ylmethyl)-1-cyclohex-2-enone 3-(2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-1-ylmethyl)cyclohex-2-en-1-one
Wiley ID 1284298