CID 3492378
5-phenyl-1,2,4-oxadiazol-3-yl n-(2-chloroethyl)carbamate
Structural Information
- Molecular Formula
- C11H10ClN3O3
- SMILES
- C1=CC=C(C=C1)C2=NC(=NO2)OC(=O)NCCCl
- InChI
- InChI=1S/C11H10ClN3O3/c12-6-7-13-11(16)17-10-14-9(18-15-10)8-4-2-1-3-5-8/h1-5H,6-7H2,(H,13,16)
- InChIKey
- QSSFTMAZGZFMIV-UHFFFAOYSA-N
- Compound name
- (5-phenyl-1,2,4-oxadiazol-3-yl) N-(2-chloroethyl)carbamate
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 268.04836 | 156.1 |
[M+Na]+ | 290.03030 | 164.5 |
[M-H]- | 266.03380 | 160.9 |
[M+NH4]+ | 285.07490 | 170.6 |
[M+K]+ | 306.00424 | 161.9 |
[M+H-H2O]+ | 250.03834 | 147.6 |
[M+HCOO]- | 312.03928 | 174.8 |
[M+CH3COO]- | 326.05493 | 192.9 |
[M+Na-2H]- | 288.01575 | 161.8 |
[M]+ | 267.04053 | 160.8 |
[M]- | 267.04163 | 160.8 |
Literature stripe
No literature data available for this compound.
Patent stripe
No patent data available for this compound.