CID 46318386
Tert-butyl (5-bromo-2-hydroxybenzyl)(2-hydroxyethyl)carbamate
Structural Information
- Molecular Formula
- C14H20BrNO4
- SMILES
- CC(C)(C)OC(=O)N(CCO)CC1=C(C=CC(=C1)Br)O
- InChI
- InChI=1S/C14H20BrNO4/c1-14(2,3)20-13(19)16(6-7-17)9-10-8-11(15)4-5-12(10)18/h4-5,8,17-18H,6-7,9H2,1-3H3
- InChIKey
- YFNZPSVBCBMUEW-UHFFFAOYSA-N
- Compound name
- tert-butyl N-[(5-bromo-2-hydroxyphenyl)methyl]-N-(2-hydroxyethyl)carbamate
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 346.06484 | 172.7 |
[M+Na]+ | 368.04678 | 181.2 |
[M-H]- | 344.05028 | 177.3 |
[M+NH4]+ | 363.09138 | 189.0 |
[M+K]+ | 384.02072 | 170.8 |
[M+H-H2O]+ | 328.05482 | 171.4 |
[M+HCOO]- | 390.05576 | 189.9 |
[M+CH3COO]- | 404.07141 | 207.3 |
[M+Na-2H]- | 366.03223 | 175.9 |
[M]+ | 345.05701 | 193.6 |
[M]- | 345.05811 | 193.6 |
Literature stripe
No literature data available for this compound.