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4-(3'-Methoxyphenyl)-3-(morpholinomethyl)-thiepan-4-ol - hydrochloride

View entire compound with spectra: 2 MS (GC)

4-(3'-Methoxyphenyl)-3-(morpholinomethyl)-thiepan-4-ol - hydrochloride
SpectraBase Compound ID 1enOSwsNPuh
InChI InChI=1S/C18H27NO3S.ClH/c1-21-17-5-2-4-15(12-17)18(20)6-3-11-23-14-16(18)13-19-7-9-22-10-8-19;/h2,4-5,12,16,20H,3,6-11,13-14H2,1H3;1H
InChIKey ZLYJVOURLIKXSM-UHFFFAOYSA-N
Mol Weight 373.94 g/mol
Molecular Formula C18H28ClNO3S
Exact Mass 373.147843 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7IFDblJRSyy
Name 4-(3'-Methoxyphenyl)-3-(morpholinomethyl)-thiepan-4-ol - hydrochloride
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H28ClNO3S
InChI InChI=1S/C18H27NO3S.ClH/c1-21-17-5-2-4-15(12-17)18(20)6-3-11-23-14-16(18)13-19-7-9-22-10-8-19;/h2,4-5,12,16,20H,3,6-11,13-14H2,1H3;1H
InChIKey ZLYJVOURLIKXSM-UHFFFAOYSA-N
Molecular Weight 373.939 g/mol
SMILES Cl.OC1(C(CN2CCOCC2)CSCCC1)c1cc(OC)ccc1
SPLASH splash10-0udi-1900000000-bc5357512bf66cc1a385
Source of Spectrum D8-330-363-10
Synonyms 4-(3-Methoxyphenyl)-3-(morpholin-4-ylmethyl)thiepan-4-ol hydrochloride 4-(3'-Methoxyphenyl)-3-(morpholinomethyl)-thiepan-4-ol Hydrochloride 4-(3-Methoxyphenyl)-3-(morpholinomethyl)thiepan-4-ol hydrochloride
Wiley ID 1516471