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3-benzyl-2-cyano-3-methylvaleric acid, ethyl ester
SpectraBase Compound ID KCG9A6scaFZ
InChI InChI=1S/C16H21NO2/c1-4-16(3,11-13-9-7-6-8-10-13)14(12-17)15(18)19-5-2/h6-10,14H,4-5,11H2,1-3H3
InChIKey NRQJBGPWJLKSHK-UHFFFAOYSA-N
Mol Weight 259.35 g/mol
Molecular Formula C16H21NO2
Exact Mass 259.157229 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 5vZbqp3kdGO
Name VALERIC ACID, 3-BENZYL-2-CYANO- 3-METHYL-, ETHYL ESTER
Boiling Point 171C/1mm
CAS Registry Number 70289-04-2
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Detector Name TGS/TRIGLYCINE SULFATE/
Formula C16H21NO2
InChI InChI=1S/C16H21NO2/c1-4-16(3,11-13-9-7-6-8-10-13)14(12-17)15(18)19-5-2/h6-10,14H,4-5,11H2,1-3H3
InChIKey NRQJBGPWJLKSHK-UHFFFAOYSA-N
Instrument Name DIGILAB FTS-14
Molecular Weight 259.35
Technique Vapor Phase