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Benzonitrile, 4-[(4-hydroxy-1-methylbutoxy)methyl]-
SpectraBase Compound ID 3qbg4OU60Iq
InChI InChI=1S/C13H17NO2/c1-11(3-2-8-15)16-10-13-6-4-12(9-14)5-7-13/h4-7,11,15H,2-3,8,10H2,1H3
InChIKey QKORXFFPLUVHOU-UHFFFAOYSA-N
Mol Weight 219.28 g/mol
Molecular Formula C13H17NO2
Exact Mass 219.125929 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID H0McxgCBKX6
Name Benzonitrile, 4-[(4-hydroxy-1-methylbutoxy)methyl]-
Alternate Name(s) 4-(4-Cyanobenzyloxy)-1-pentanol 4-[(4-hydroxy-1-methylbutoxy)methyl]benzonitrile
CAS Registry Number 73476-17-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H17NO2
InChI InChI=1S/C13H17NO2/c1-11(3-2-8-15)16-10-13-6-4-12(9-14)5-7-13/h4-7,11,15H,2-3,8,10H2,1H3
InChIKey QKORXFFPLUVHOU-UHFFFAOYSA-N
Molecular Weight 219.284 g/mol
SMILES OCCCC(OCc1ccc(C#N)cc1)C
SPLASH splash10-0159-0900000000-b3f279d304b91953dba4
Source of Spectrum K-114-956-0
Wiley ID 1218880