CID 18526153
7-nitro-2,3-dihydro-1-benzofuran-5-sulfonoyl chloride
Structural Information
- Molecular Formula
- C8H6ClNO5S
- SMILES
- C1COC2=C1C=C(C=C2[N+](=O)[O-])S(=O)(=O)Cl
- InChI
- InChI=1S/C8H6ClNO5S/c9-16(13,14)6-3-5-1-2-15-8(5)7(4-6)10(11)12/h3-4H,1-2H2
- InChIKey
- KFYKLVMQGONPLM-UHFFFAOYSA-N
- Compound name
- 7-nitro-2,3-dihydro-1-benzofuran-5-sulfonyl chloride
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 263.97278 | 150.8 |
[M+Na]+ | 285.95472 | 160.0 |
[M-H]- | 261.95822 | 156.8 |
[M+NH4]+ | 280.99932 | 169.5 |
[M+K]+ | 301.92866 | 153.7 |
[M+H-H2O]+ | 245.96276 | 152.0 |
[M+HCOO]- | 307.96370 | 164.7 |
[M+CH3COO]- | 321.97935 | 182.1 |
[M+Na-2H]- | 283.94017 | 158.6 |
[M]+ | 262.96495 | 154.7 |
[M]- | 262.96605 | 154.7 |
Literature stripe
No literature data available for this compound.