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3-Morpholinobenzonitrile
SpectraBase Compound ID 2flPCBJoKtr
InChI InChI=1S/C11H12N2O/c12-9-10-2-1-3-11(8-10)13-4-6-14-7-5-13/h1-3,8H,4-7H2
InChIKey OQRDPCPTEDSJHU-UHFFFAOYSA-N
Mol Weight 188.23 g/mol
Molecular Formula C11H12N2O
Exact Mass 188.094963 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ITREDMeu8Yg
Name 3-Morpholinobenzonitrile
Appearance Pale yellow solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 188.094963013 u
Formula C11H12N2O
GC Column Varian (25 m x 0.25 mm, film thickness 0.25 micrometer)
InChI InChI=1S/C11H12N2O/c12-9-10-2-1-3-11(8-10)13-4-6-14-7-5-13/h1-3,8H,4-7H2
InChIKey OQRDPCPTEDSJHU-UHFFFAOYSA-N
Instrument Name Thermo Scientific ITQ 700 GCMS
Ionization Type EI positive ion
Literature Reference DOI 10.1021/acs.joc.2c01964
Molecular Weight 188.230 g/mol
Quality 235
SMILES C1OCCN(C1)C=1C=C(C=CC1)C#N
SPLASH splash10-005i-0900000000-fcdc9cdc3407e9269f6a
Source of Spectrum JOC-88-679-3e (DOI: 10.1021/acs.joc.2c01964)
Wiley ID 1912582