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(+-)-(3aR*,4R*,11bR*)-Methyl 3-[(Z)-2-(Iodobut-2-en-1-yl)]-2,3,3a,4,5,7-hexahydro-4-hydroxy-1H-pyrrolo[2,3-d]carbazole-6-carboxylate

View entire compound with spectra: 1 MS (GC)

(+-)-(3aR*,4R*,11bR*)-Methyl 3-[(Z)-2-(Iodobut-2-en-1-yl)]-2,3,3a,4,5,7-hexahydro-4-hydroxy-1H-pyrrolo[2,3-d]carbazole-6-carboxylate
SpectraBase Compound ID DnBamaoUD6
InChI InChI=1S/C20H23IN2O3/c1-3-12(21)11-23-9-8-20-14-6-4-5-7-15(14)22-17(20)13(19(25)26-2)10-16(24)18(20)23/h3-7,16,18,22,24H,8-11H2,1-2H3/b12-3-/t16?,18-,20-/m0/s1
InChIKey BXUZXDGIPFGMOY-GGAQUFSUSA-N
Mol Weight 466.32 g/mol
Molecular Formula C20H23IN2O3
Exact Mass 466.075338 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LNwpZBNcGJK
Name (+-)-(3aR*,4R*,11bR*)-Methyl 3-[(Z)-2-(Iodobut-2-en-1-yl)]-2,3,3a,4,5,7-hexahydro-4-hydroxy-1H-pyrrolo[2,3-d]carbazole-6-carboxylate
Alternate Name(s) Methyl (3aR,11bR)-4-hydroxy-3-[(2Z)-2-iodo-2-butenyl]-2,3,3a,4,5,7-hexahydro-1H-pyrrolo[2,3-d]carbazole-6-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H23IN2O3
InChI InChI=1S/C20H23IN2O3/c1-3-12(21)11-23-9-8-20-14-6-4-5-7-15(14)22-17(20)13(19(25)26-2)10-16(24)18(20)23/h3-7,16,18,22,24H,8-11H2,1-2H3/b12-3-/t16?,18-,20-/m0/s1
InChIKey BXUZXDGIPFGMOY-GGAQUFSUSA-N
Molecular Weight 466.319 g/mol
SMILES OC1[C@]2([C@@]3(C(=C(C1)C(=O)OC)Nc1ccccc31)CCN2C\C(=C\C)I)[H]
SPLASH splash10-0udi-9870100000-3293df29e48bb40510c6
Source of Spectrum J-61-7876-11
Wiley ID 1391862