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2H-3,7-Methanoazacycloundecino[5,4-b]indole-9-carboxylic acid, 5-ethyl-1,4,5,6,7,8,9,10-octahydro-, methyl ester, [5S-(5R*,7R*,9S*)]-
SpectraBase Compound ID 9uhZfrnuabr
InChI InChI=1S/C21H28N2O2/c1-3-14-10-15-11-18(21(24)25-2)20-17(8-9-23(12-14)13-15)16-6-4-5-7-19(16)22-20/h4-7,14-15,18,22H,3,8-13H2,1-2H3
InChIKey OXTRSDFIRKYKEX-UHFFFAOYSA-N
Mol Weight 340.47 g/mol
Molecular Formula C21H28N2O2
Exact Mass 340.215078 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID OnedFEXf5M
Name 2H-3,7-Methanoazacycloundecino[5,4-b]indole-9-carboxylic acid, 5-ethyl-1,4,5,6,7,8,9,10-octahydro-, methyl ester, [5S-(5R*,7R*,9S*)]-
CAS Registry Number 26251-90-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H28N2O2
InChI InChI=1S/C21H28N2O2/c1-3-14-10-15-11-18(21(24)25-2)20-17(8-9-23(12-14)13-15)16-6-4-5-7-19(16)22-20/h4-7,14-15,18,22H,3,8-13H2,1-2H3
InChIKey OXTRSDFIRKYKEX-UHFFFAOYSA-N
Molecular Weight 340.467 g/mol
SMILES [nH]1c2C(CC3CN(CCc2c2ccccc12)CC(C3)CC)C(=O)OC
SPLASH splash10-007c-3942000000-22953b3ad5dcf3b9ee44
Source of Spectrum W5-30279-0-0
Synonyms Cleavamine, 18.beta.-carboxy-3,4.alpha.-dihydro-, methyl ester
Wiley ID 1335429