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3-Phenyl-3-octanol
SpectraBase Compound ID DJhX77pD2Qr
InChI InChI=1S/C14H22O/c1-3-5-9-12-14(15,4-2)13-10-7-6-8-11-13/h6-8,10-11,15H,3-5,9,12H2,1-2H3
InChIKey MTQRPBCLUIHXNH-UHFFFAOYSA-N
Mol Weight 206.33 g/mol
Molecular Formula C14H22O
Exact Mass 206.167065 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID E2FDO7SbiCF
Name 3-Phenyl-3-octanol
Alternate Name(s) 3-Phenyloctan-3-ol
CAS Registry Number 20739-53-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H22O
InChI InChI=1S/C14H22O/c1-3-5-9-12-14(15,4-2)13-10-7-6-8-11-13/h6-8,10-11,15H,3-5,9,12H2,1-2H3
InChIKey MTQRPBCLUIHXNH-UHFFFAOYSA-N
Molecular Weight 206.329 g/mol
SMILES OC(c1ccccc1)(CC)CCCCC
SPLASH splash10-0570-5900000000-91ace7c28e9c2845227b
Source of Spectrum Z-1981-0-0
Wiley ID 1204976