CID 120655
Brn 2566897
Structural Information
- Molecular Formula
- C16H17NO4
- SMILES
- C1=CC=C(C=C1)C2=CC=CC=C2OCC(COC(=O)N)O
- InChI
- InChI=1S/C16H17NO4/c17-16(19)21-11-13(18)10-20-15-9-5-4-8-14(15)12-6-2-1-3-7-12/h1-9,13,18H,10-11H2,(H2,17,19)
- InChIKey
- SHUUJTPQYWWLSZ-UHFFFAOYSA-N
- Compound name
- [2-hydroxy-3-(2-phenylphenoxy)propyl] carbamate
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 288.12303 | 165.8 |
[M+Na]+ | 310.10497 | 170.5 |
[M-H]- | 286.10847 | 170.3 |
[M+NH4]+ | 305.14957 | 179.5 |
[M+K]+ | 326.07891 | 167.8 |
[M+H-H2O]+ | 270.11301 | 157.6 |
[M+HCOO]- | 332.11395 | 187.4 |
[M+CH3COO]- | 346.12960 | 199.6 |
[M+Na-2H]- | 308.09042 | 168.6 |
[M]+ | 287.11520 | 166.0 |
[M]- | 287.11630 | 166.0 |
Literature stripe
No literature data available for this compound.
Patent stripe
No patent data available for this compound.