CID 207270
Carbamic acid, (hydroxymethyl)-, 3,4,5-trimethylphenyl ester
Structural Information
- Molecular Formula
- C11H15NO3
- SMILES
- CC1=CC(=CC(=C1C)C)OC(=O)NCO
- InChI
- InChI=1S/C11H15NO3/c1-7-4-10(5-8(2)9(7)3)15-11(14)12-6-13/h4-5,13H,6H2,1-3H3,(H,12,14)
- InChIKey
- IXCHGQAKYHQRAP-UHFFFAOYSA-N
- Compound name
- (3,4,5-trimethylphenyl) N-(hydroxymethyl)carbamate
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 210.11248 | 145.4 |
[M+Na]+ | 232.09442 | 153.5 |
[M-H]- | 208.09792 | 148.4 |
[M+NH4]+ | 227.13902 | 164.1 |
[M+K]+ | 248.06836 | 151.8 |
[M+H-H2O]+ | 192.10246 | 139.6 |
[M+HCOO]- | 254.10340 | 168.7 |
[M+CH3COO]- | 268.11905 | 188.0 |
[M+Na-2H]- | 230.07987 | 149.0 |
[M]+ | 209.10465 | 147.4 |
[M]- | 209.10575 | 147.4 |
Literature stripe
No literature data available for this compound.
Patent stripe
No patent data available for this compound.