CID 4098635
Carbobenzyloxy-o-benzyl-l-tyrosine n-hydroxysuccinimide ester
Structural Information
- Molecular Formula
- C28H26N2O7
- SMILES
- C1CC(=O)N(C1=O)OC(=O)C(CC2=CC=C(C=C2)OCC3=CC=CC=C3)NC(=O)OCC4=CC=CC=C4
- InChI
- InChI=1S/C28H26N2O7/c31-25-15-16-26(32)30(25)37-27(33)24(29-28(34)36-19-22-9-5-2-6-10-22)17-20-11-13-23(14-12-20)35-18-21-7-3-1-4-8-21/h1-14,24H,15-19H2,(H,29,34)
- InChIKey
- YFQGJQWXLNZGIA-UHFFFAOYSA-N
- Compound name
- (2,5-dioxopyrrolidin-1-yl) 2-(phenylmethoxycarbonylamino)-3-(4-phenylmethoxyphenyl)propanoate
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 503.18128 | 217.1 |
[M+Na]+ | 525.16322 | 218.1 |
[M-H]- | 501.16672 | 227.4 |
[M+NH4]+ | 520.20782 | 221.6 |
[M+K]+ | 541.13716 | 215.4 |
[M+H-H2O]+ | 485.17126 | 205.0 |
[M+HCOO]- | 547.17220 | 235.5 |
[M+CH3COO]- | 561.18785 | 239.7 |
[M+Na-2H]- | 523.14867 | 214.0 |
[M]+ | 502.17345 | 219.2 |
[M]- | 502.17455 | 219.2 |
Literature stripe
No literature data available for this compound.
Patent stripe
No patent data available for this compound.