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3-Methoxy-2,3,3a,4,5,6,7,8,9,10,11,12-dodecahydro-1H-cyclododeca[b]pyrrole-13-carboxylic acid ethyl ester
SpectraBase Compound ID CHlTSN1IRLJ
InChI InChI=1S/C18H31NO3/c1-3-22-18(20)15-12-10-8-6-4-5-7-9-11-14-16(21-2)13-19-17(14)15/h14,16,19H,3-13H2,1-2H3/b17-15-
InChIKey VSIJSLNKDXAOHO-ICFOKQHNSA-N
Mol Weight 309.45 g/mol
Molecular Formula C18H31NO3
Exact Mass 309.230394 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GPTx4ICMcVJ
Name 3-Methoxy-2,3,3a,4,5,6,7,8,9,10,11,12-dodecahydro-1H-cyclododeca[b]pyrrole-13-carboxylic acid ethyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H31NO3
InChI InChI=1S/C18H31NO3/c1-3-22-18(20)15-12-10-8-6-4-5-7-9-11-14-16(21-2)13-19-17(14)15/h14,16,19H,3-13H2,1-2H3/b17-15-
InChIKey VSIJSLNKDXAOHO-ICFOKQHNSA-N
Molecular Weight 309.450 g/mol
SMILES N1CC(C2\C1=C\(CCCCCCCCC2)C(=O)OCC)OC
SPLASH splash10-004i-0091000000-2a45e0b305ed071b9c97
Source of Spectrum F-70-4759-4
Synonyms Ethyl 3-methoxy-2,3,3a,4,5,6,7,8,9,10,11,12-dodecahydro-1H-cyclododeca[b]pyrrole-13-carboxylate Ethyl (13Z)-3-methoxy-2,3,3a,4,5,6,7,8,9,10,11,12-dodecahydro-1H-cyclododeca[b]pyrrole-13-carboxylate
Wiley ID 1597029