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(5R)-1-aza-3(R)-phenyl-4(S)-(((tert-butyldimethylsilyl)oxy)methyl)-4(S)-carboxy-6(R)-hydroxybicyclo[3.3.0]octane lactone
SpectraBase Compound ID I7Pg4nB4GJS
InChI InChI=1S/C21H31NO3Si/c1-20(2,3)26(4,5)24-14-21-16(15-9-7-6-8-10-15)13-22-12-11-17(18(21)22)25-19(21)23/h6-10,16-18H,11-14H2,1-5H3/t16-,17-,18+,21+/m1/s1
InChIKey YHTKEMVQVPEAKU-WIRSXHRWSA-N
Mol Weight 373.57 g/mol
Molecular Formula C21H31NO3Si
Exact Mass 373.20732 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DYDRpRl0HvB
Name (5R)-1-aza-3(R)-phenyl-4(S)-(((tert-butyldimethylsilyl)oxy)methyl)-4(S)-carboxy-6(R)-hydroxybicyclo[3.3.0]octane lactone
Alternate Name(s) (2aS,3R,6aR,6bR)-2a-({[tert-butyl(dimethyl)silyl]oxy}methyl)-3-phenylhexahydro-1-oxa-4a-azacyclopenta[cd]pentalen-2(2aH)-one
CAS Registry Number 126191-49-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H31NO3Si
InChI InChI=1S/C21H31NO3Si/c1-20(2,3)26(4,5)24-14-21-16(15-9-7-6-8-10-15)13-22-12-11-17(18(21)22)25-19(21)23/h6-10,16-18H,11-14H2,1-5H3/t16-,17-,18+,21+/m1/s1
InChIKey YHTKEMVQVPEAKU-WIRSXHRWSA-N
Molecular Weight 373.568 g/mol
SMILES [C@@]12(C(O[C@]3([C@@]2(N(CC3)C[C@@]1(c1ccccc1)[H])[H])[H])=O)CO[Si](C(C)(C)C)(C)C
SPLASH splash10-014j-4439000000-c8ce73a3fa193396da3c
Source of Spectrum J-55-3402-6
Wiley ID 1356152