CID 110795

Brn 3381395

Structural Information

Molecular Formula
C14H19NO4
SMILES
C1CCC2=C(C1)C=CC(=C2)OCC(COC(=O)N)O
InChI
InChI=1S/C14H19NO4/c15-14(17)19-9-12(16)8-18-13-6-5-10-3-1-2-4-11(10)7-13/h5-7,12,16H,1-4,8-9H2,(H2,15,17)
InChIKey
NWSILLQQTSAKHH-UHFFFAOYSA-N
Compound name
[2-hydroxy-3-(5,6,7,8-tetrahydronaphthalen-2-yloxy)propyl] carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

265.1314 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 266.13868 159.5
[M+Na]+ 288.12062 163.1
[M-H]- 264.12412 161.0
[M+NH4]+ 283.16522 175.3
[M+K]+ 304.09456 161.2
[M+H-H2O]+ 248.12866 152.6
[M+HCOO]- 310.12960 177.2
[M+CH3COO]- 324.14525 196.1
[M+Na-2H]- 286.10607 162.2
[M]+ 265.13085 157.6
[M]- 265.13195 157.6
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.