(-)-N-[(2'S,3'S)-2'-Phenyllthio-3'-hydroxyhexyl]-(R)-alanine tert-butyl ester

SpectraBase Compound ID	Pugd9Dtl0P
InChI	InChI=1S/C19H31NO3S/c1-6-10-16(21)17(24-15-11-8-7-9-12-15)13-20-14(2)18(22)23-19(3,4)5/h7-9,11-12,14,16-17,20-21H,6,10,13H2,1-5H3/t14-,16+,17+/m1/s1
InChIKey	CXFOITQUIRRDFG-PVAVHDDUSA-N Google Search
Mol Weight	353.52 g/mol
Molecular Formula	C19H31NO3S
Exact Mass	353.202465 g/mol

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SpectraBase Spectrum ID	4QGAn58i3c
Name	(-)-N-[(2'S,3'S)-2'-Phenyllthio-3'-hydroxyhexyl]-(R)-alanine tert-butyl ester
Alternate Name(s)	(-)-N-[(2'S,3'S)-2'-Phenylthio-3'-hydroxyhexyl]-(R)-alanine tert-butyl ester
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C19H31NO3S
InChI	InChI=1S/C19H31NO3S/c1-6-10-16(21)17(24-15-11-8-7-9-12-15)13-20-14(2)18(22)23-19(3,4)5/h7-9,11-12,14,16-17,20-21H,6,10,13H2,1-5H3/t14-,16+,17+/m1/s1
InChIKey	CXFOITQUIRRDFG-PVAVHDDUSA-N
Molecular Weight	353.521 g/mol
SMILES	N([C@@](C(OC(C)(C)C)=O)(C)[H])C[C@@]([C@@](O)(CCC)[H])(Sc1ccccc1)[H]
SPLASH	splash10-0ufr-0900000000-78de6bd080354e0c7c01
Source of Spectrum	F-53-3390-14b
Wiley ID	800947