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t-Butyl (S)-N-[(S)-4-(9H-Fluoren-9-ylmethoxycarbonylamino)-2-hydroxy-butyryl]-phenylalaninate
SpectraBase Compound ID KYammCaOcnv
InChI InChI=1S/C32H36N2O6/c1-32(2,3)40-30(37)27(19-21-11-5-4-6-12-21)34-29(36)28(35)17-18-33-31(38)39-20-26-24-15-9-7-13-22(24)23-14-8-10-16-25(23)26/h4-16,26-28,35H,17-20H2,1-3H3,(H,33,38)(H,34,36)/t27-,28-/m0/s1
InChIKey ZOORAPAPJWWIDD-NSOVKSMOSA-N
Mol Weight 544.6 g/mol
Molecular Formula C32H36N2O6
Exact Mass 544.257337 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JU5CZ48nDYN
Name t-Butyl (S)-N-[(S)-4-(9H-Fluoren-9-ylmethoxycarbonylamino)-2-hydroxy-butyryl]-phenylalaninate
Alternate Name(s) t-Butyl {4'-[(9''-fluorenyl)methoxycarbonylamino]-2'-(hydroxybutyryl)}-phenylalaninate tert-butyl (2S)-2-[((2S)-4-{[(9H-fluoren-9-ylmethoxy)carbonyl]amino}-2-hydroxybutanoyl)amino]-3-phenylpropanoate
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C32H36N2O6
InChI InChI=1S/C32H36N2O6/c1-32(2,3)40-30(37)27(19-21-11-5-4-6-12-21)34-29(36)28(35)17-18-33-31(38)39-20-26-24-15-9-7-13-22(24)23-14-8-10-16-25(23)26/h4-16,26-28,35H,17-20H2,1-3H3,(H,33,38)(H,34,36)/t27-,28-/m0/s1
InChIKey ZOORAPAPJWWIDD-NSOVKSMOSA-N
Molecular Weight 544.648 g/mol
SMILES N(C(OCC1c2c(cccc2)-c2c1cccc2)=O)CC[C@@](C(N[C@](C(OC(C)(C)C)=O)(Cc1ccccc1)[H])=O)(O)[H]
SPLASH splash10-004i-0900000000-69d49433cf1234e7fe39
Source of Spectrum SB-136-773-22
Wiley ID 1612199