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Cyclopentadecanecarboxylic acid, 13-cyano-2-oxo-, methyl ester
SpectraBase Compound ID E5FKx0v5oy0
InChI InChI=1S/C18H29NO3/c1-22-18(21)16-13-12-15(14-19)10-8-6-4-2-3-5-7-9-11-17(16)20/h15-16H,2-13H2,1H3
InChIKey RZYQLILXNALSBH-UHFFFAOYSA-N
Mol Weight 307.43 g/mol
Molecular Formula C18H29NO3
Exact Mass 307.214744 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9EpHdSGi4dm
Name Cyclopentadecanecarboxylic acid, 13-cyano-2-oxo-, methyl ester
Alternate Name(s) Methyl 13-cyano-2-oxocyclopentadecanecarboxylate
CAS Registry Number 104951-31-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H29NO3
InChI InChI=1S/C18H29NO3/c1-22-18(21)16-13-12-15(14-19)10-8-6-4-2-3-5-7-9-11-17(16)20/h15-16H,2-13H2,1H3
InChIKey RZYQLILXNALSBH-UHFFFAOYSA-N
Molecular Weight 307.434 g/mol
SMILES C1(C(=O)OC)C(=O)CCCCCCCCCCC(C#N)CC1
SPLASH splash10-052f-6910000000-b4c62d155bce6b0d2e46
Source of Spectrum H-68-1995-28
Wiley ID 1309075