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2-Propen-1-ol, 3-(4-amino-1,3,4,5-tetrahydrobenz[cd]indol-5-yl)-2-methyl-, [4R-[4.alpha.,5.beta.(E)]]-
SpectraBase Compound ID 32mZFP1Jefl
InChI InChI=1S/C15H18N2O/c1-9(8-18)5-12-11-3-2-4-14-15(11)10(7-17-14)6-13(12)16/h2-5,7,12-13,17-18H,6,8,16H2,1H3/b9-5+/t12-,13-/m1/s1
InChIKey QPYLOULWBAJLGK-UDHZEARHSA-N
Mol Weight 242.32 g/mol
Molecular Formula C15H18N2O
Exact Mass 242.141913 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BcvCUTJ1QCP
Name 2-Propen-1-ol, 3-(4-amino-1,3,4,5-tetrahydrobenz[cd]indol-5-yl)-2-methyl-, [4R-[4.alpha.,5.beta.(E)]]-
Alternate Name(s) (2E)-3-[(4R,5R)-4-amino-1,3,4,5-tetrahydrobenzo[cd]indol-5-yl]-2-methyl-2-propen-1-ol Benz[cd]indole, 2-propen-1-ol deriv. N-Demethylchanoclavine-I Norchanoclavine I Norchanoclavines
CAS Registry Number 51743-69-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H18N2O
InChI InChI=1S/C15H18N2O/c1-9(8-18)5-12-11-3-2-4-14-15(11)10(7-17-14)6-13(12)16/h2-5,7,12-13,17-18H,6,8,16H2,1H3/b9-5+/t12-,13-/m1/s1
InChIKey QPYLOULWBAJLGK-UDHZEARHSA-N
Molecular Weight 242.322 g/mol
SMILES [nH]1c2cccc3c2c(C[C@]([C@@]3(\C=C\(CO)C)[H])(N)[H])c1
SPLASH splash10-0ldi-0920000000-ab102b6bd53d5d9113ea
Source of Spectrum KO-9-164-1
Wiley ID 1245365