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Oxepane, 2-[2-(phenylmethoxy)ethyl]-7-propyl-, (2R-cis)-
SpectraBase Compound ID 5PZqjyoLlKi
InChI InChI=1S/C18H28O2/c1-2-8-17-11-6-7-12-18(20-17)13-14-19-15-16-9-4-3-5-10-16/h3-5,9-10,17-18H,2,6-8,11-15H2,1H3/t17-,18-/m1/s1
InChIKey JYWQFKPKKBXKES-QZTJIDSGSA-N
Mol Weight 276.42 g/mol
Molecular Formula C18H28O2
Exact Mass 276.20893 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1AHUgp2bjmb
Name Oxepane, 2-[2-(phenylmethoxy)ethyl]-7-propyl-, (2R-cis)-
Alternate Name(s) (2R,7R)-2-[2-(benzyloxy)ethyl]-7-propyl-1-oxacycloheptane (2R,7R)-2-[2-(benzyloxy)ethyl]-7-propyloxepane benzyl 2-[(2R,7R)-7-propyloxepanyl]ethyl ether
CAS Registry Number 123151-71-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H28O2
InChI InChI=1S/C18H28O2/c1-2-8-17-11-6-7-12-18(20-17)13-14-19-15-16-9-4-3-5-10-16/h3-5,9-10,17-18H,2,6-8,11-15H2,1H3/t17-,18-/m1/s1
InChIKey JYWQFKPKKBXKES-QZTJIDSGSA-N
Molecular Weight 276.420 g/mol
SMILES [C@@]1(O[C@@](CCCC1)(CCC)[H])(CCOCc1ccccc1)[H]
SPLASH splash10-0006-5910000000-7b05f08f66965dec921a
Source of Spectrum J-54-5159-22
Wiley ID 1280496