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Cyclobutanecarboxylic acid, 2-(cyanomethyl)-, butyl ester, cis-
SpectraBase Compound ID 9U2GCSsJhVQ
InChI InChI=1S/C11H17NO2/c1-2-3-8-14-11(13)10-5-4-9(10)6-7-12/h9-10H,2-6,8H2,1H3/t9-,10-/m1/s1
InChIKey OSCMAEJHPSMUSV-NXEZZACHSA-N
Mol Weight 195.26 g/mol
Molecular Formula C11H17NO2
Exact Mass 195.125929 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID SDgAHxal7A
Name Cyclobutanecarboxylic acid, 2-(cyanomethyl)-, butyl ester, cis-
Alternate Name(s) Butyl (1R,2R)-2-(cyanomethyl)cyclobutanecarboxylate Butyl cis-2-(cyanomethyl)cyclobutanecarboxylate
CAS Registry Number 84673-49-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H17NO2
InChI InChI=1S/C11H17NO2/c1-2-3-8-14-11(13)10-5-4-9(10)6-7-12/h9-10H,2-6,8H2,1H3/t9-,10-/m1/s1
InChIKey OSCMAEJHPSMUSV-NXEZZACHSA-N
Molecular Weight 195.262 g/mol
SMILES C([C@@]1(CC[C@@]1(CC#N)[H])[H])(=O)OCCCC
SPLASH splash10-006x-9400000000-9db6a7e09a73a84df829
Source of Spectrum KC-1982-2560-0
Wiley ID 1192074