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tert-Butyl (2S,4R,2'S)-4-(N-(n-Butoxycarbonyl)pyrrolidin-2'-yl)-2-isopropyl-3-oxahex-5-ynoate
SpectraBase Compound ID DK24Id2hOcz
InChI InChI=1S/C21H35NO5/c1-8-10-14-25-20(24)22-13-11-12-16(22)17(9-2)26-18(15(3)4)19(23)27-21(5,6)7/h2,15-18H,8,10-14H2,1,3-7H3/t16-,17+,18-/m0/s1
InChIKey IWRLBYBHSOYKJV-KSZLIROESA-N
Mol Weight 381.5 g/mol
Molecular Formula C21H35NO5
Exact Mass 381.251523 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 34Hee5FTlAd
Name tert-Butyl (2S,4R,2'S)-4-(N-(n-Butoxycarbonyl)pyrrolidin-2'-yl)-2-isopropyl-3-oxahex-5-ynoate
Alternate Name(s) Butyl (2S)-2-((1R)-1-{[(1S)-1-(tert-butoxycarbonyl)-2-methylpropyl]oxy}-2-propynyl)-1-pyrrolidinecarboxylate
CAS Registry Number 132127-57-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H35NO5
InChI InChI=1S/C21H35NO5/c1-8-10-14-25-20(24)22-13-11-12-16(22)17(9-2)26-18(15(3)4)19(23)27-21(5,6)7/h2,15-18H,8,10-14H2,1,3-7H3/t16-,17+,18-/m0/s1
InChIKey IWRLBYBHSOYKJV-KSZLIROESA-N
Molecular Weight 381.513 g/mol
SMILES C(N1[C@]([C@](O[C@](C(OC(C)(C)C)=O)(C(C)C)[H])(C#C)[H])(CCC1)[H])(=O)OCCCC
SPLASH splash10-00di-2910000000-8512392f9a032b62dd6b
Source of Spectrum J-56-2633-25
Wiley ID 1360205