CID 199258
Hc 1657
Structural Information
- Molecular Formula
- C15H18O3
- SMILES
- CC(CO)(CO)COC1=CC2=CC=CC=C2C=C1
- InChI
- InChI=1S/C15H18O3/c1-15(9-16,10-17)11-18-14-7-6-12-4-2-3-5-13(12)8-14/h2-8,16-17H,9-11H2,1H3
- InChIKey
- NSBBGDHVTCXAQV-UHFFFAOYSA-N
- Compound name
- 2-methyl-2-(naphthalen-2-yloxymethyl)propane-1,3-diol
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 247.13288 | 156.6 |
[M+Na]+ | 269.11482 | 163.2 |
[M-H]- | 245.11832 | 158.1 |
[M+NH4]+ | 264.15942 | 173.7 |
[M+K]+ | 285.08876 | 159.4 |
[M+H-H2O]+ | 229.12286 | 150.7 |
[M+HCOO]- | 291.12380 | 175.1 |
[M+CH3COO]- | 305.13945 | 189.3 |
[M+Na-2H]- | 267.10027 | 164.0 |
[M]+ | 246.12505 | 157.9 |
[M]- | 246.12615 | 157.9 |
Literature stripe
No literature data available for this compound.