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N-Phthaloyl-O(1)-tosyl-L-leucinol
SpectraBase Compound ID 36fZrTgIctW
InChI InChI=1S/C21H23NO5S/c1-14(2)12-16(13-27-28(25,26)17-10-8-15(3)9-11-17)22-20(23)18-6-4-5-7-19(18)21(22)24/h4-11,14,16H,12-13H2,1-3H3/t16-/m0/s1
InChIKey MOQMVVDRIQPCMK-INIZCTEOSA-N
Mol Weight 401.48 g/mol
Molecular Formula C21H23NO5S
Exact Mass 401.129694 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AKrZN1ndLXi
Name N-Phthaloyl-O(1)-tosyl-L-leucinol
Alternate Name(s) (2S)-2-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-4-methylpentyl 4-methylbenzenesulfonate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H23NO5S
InChI InChI=1S/C21H23NO5S/c1-14(2)12-16(13-27-28(25,26)17-10-8-15(3)9-11-17)22-20(23)18-6-4-5-7-19(18)21(22)24/h4-11,14,16H,12-13H2,1-3H3/t16-/m0/s1
InChIKey MOQMVVDRIQPCMK-INIZCTEOSA-N
Molecular Weight 401.477 g/mol
SMILES C1(N(C(c2ccccc12)=O)[C@](COS(c1ccc(cc1)C)(=O)=O)(CC(C)C)[H])=O
SPLASH splash10-0296-1797000000-6c46568783c9fb029739
Source of Spectrum H-76-2415-25
Wiley ID 1369956