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[2-(<S>-2'-Oxo-4'-phenylazetidin-1'-yl)acetyl]-L-valyl-L-proline - benzyl ester
SpectraBase Compound ID 18vIIKbby9p
InChI InChI=1S/C28H33N3O5/c1-19(2)26(29-24(32)17-31-23(16-25(31)33)21-12-7-4-8-13-21)27(34)30-15-9-14-22(30)28(35)36-18-20-10-5-3-6-11-20/h3-8,10-13,19,22-23,26H,9,14-18H2,1-2H3,(H,29,32)/t22-,23-,26-/m0/s1
InChIKey LQHSRDIBTVMNTO-FXSPECFOSA-N
Mol Weight 491.6 g/mol
Molecular Formula C28H33N3O5
Exact Mass 491.242021 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DpVDrR1njlA
Name [2-(-2'-Oxo-4'-phenylazetidin-1'-yl)acetyl]-L-valyl-L-proline - benzyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H33N3O5
InChI InChI=1S/C28H33N3O5/c1-19(2)26(29-24(32)17-31-23(16-25(31)33)21-12-7-4-8-13-21)27(34)30-15-9-14-22(30)28(35)36-18-20-10-5-3-6-11-20/h3-8,10-13,19,22-23,26H,9,14-18H2,1-2H3,(H,29,32)/t22-,23-,26-/m0/s1
InChIKey LQHSRDIBTVMNTO-FXSPECFOSA-N
Molecular Weight 491.588 g/mol
SMILES N([C@](C(N1[C@](C(OCc2ccccc2)=O)(CCC1)[H])=O)(C(C)C)[H])C(CN1C(=O)C[C@]1(c1ccccc1)[H])=O
SPLASH splash10-0006-9040000000-72d16ca834427f110928
Source of Spectrum D8-333-250-27
Wiley ID 1516856