CID 98528
N-hydroxy mda
Structural Information
- Molecular Formula
- C10H13NO3
- SMILES
- CC(CC1=CC2=C(C=C1)OCO2)NO
- InChI
- InChI=1S/C10H13NO3/c1-7(11-12)4-8-2-3-9-10(5-8)14-6-13-9/h2-3,5,7,11-12H,4,6H2,1H3
- InChIKey
- FNDCTJYFKOQGTL-UHFFFAOYSA-N
- Compound name
- N-[1-(1,3-benzodioxol-5-yl)propan-2-yl]hydroxylamine
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 196.09682 | 141.0 |
[M+Na]+ | 218.07876 | 147.7 |
[M-H]- | 194.08226 | 145.4 |
[M+NH4]+ | 213.12336 | 159.6 |
[M+K]+ | 234.05270 | 148.0 |
[M+H-H2O]+ | 178.08680 | 135.7 |
[M+HCOO]- | 240.08774 | 161.7 |
[M+CH3COO]- | 254.10339 | 182.7 |
[M+Na-2H]- | 216.06421 | 148.2 |
[M]+ | 195.08899 | 142.1 |
[M]- | 195.09009 | 142.1 |