CID 119362
125973-99-1
Structural Information
- Molecular Formula
- C5H5ClO2
- SMILES
- C1C(=CC(=O)O1)CCl
- InChI
- InChI=1S/C5H5ClO2/c6-2-4-1-5(7)8-3-4/h1H,2-3H2
- InChIKey
- CTCZZJWSQSZQPN-UHFFFAOYSA-N
- Compound name
- 3-(chloromethyl)-2H-furan-5-one
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 133.00508 | 121.1 |
[M+Na]+ | 154.98702 | 131.0 |
[M-H]- | 130.99052 | 125.5 |
[M+NH4]+ | 150.03162 | 144.4 |
[M+K]+ | 170.96096 | 129.8 |
[M+H-H2O]+ | 114.99506 | 117.5 |
[M+HCOO]- | 176.99600 | 141.2 |
[M+CH3COO]- | 191.01165 | 167.8 |
[M+Na-2H]- | 152.97247 | 128.0 |
[M]+ | 131.99725 | 123.6 |
[M]- | 131.99835 | 123.6 |
Literature stripe
Patent stripe
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