CID 102999
Benzyl (s)-(1-(((2,5-dioxo-1-pyrrolidinyl)oxy)carbonyl)-3-methylbutyl)carbamate
Structural Information
- Molecular Formula
- C18H22N2O6
- SMILES
- CC(C)CC(C(=O)ON1C(=O)CCC1=O)NC(=O)OCC2=CC=CC=C2
- InChI
- InChI=1S/C18H22N2O6/c1-12(2)10-14(17(23)26-20-15(21)8-9-16(20)22)19-18(24)25-11-13-6-4-3-5-7-13/h3-7,12,14H,8-11H2,1-2H3,(H,19,24)
- InChIKey
- YHZUOMRURVTBMO-UHFFFAOYSA-N
- Compound name
- (2,5-dioxopyrrolidin-1-yl) 4-methyl-2-(phenylmethoxycarbonylamino)pentanoate
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 363.15508 | 183.4 |
[M+Na]+ | 385.13702 | 186.3 |
[M-H]- | 361.14052 | 188.0 |
[M+NH4]+ | 380.18162 | 195.2 |
[M+K]+ | 401.11096 | 185.6 |
[M+H-H2O]+ | 345.14506 | 174.9 |
[M+HCOO]- | 407.14600 | 202.0 |
[M+CH3COO]- | 421.16165 | 215.5 |
[M+Na-2H]- | 383.12247 | 180.0 |
[M]+ | 362.14725 | 185.4 |
[M]- | 362.14835 | 185.4 |
Literature stripe
No literature data available for this compound.