CID 44607

63716-26-7

Structural Information

Molecular Formula
C11H15NO3
SMILES
CC1=CC=CC=C1OCC(C)OC(=O)N
InChI
InChI=1S/C11H15NO3/c1-8-5-3-4-6-10(8)14-7-9(2)15-11(12)13/h3-6,9H,7H2,1-2H3,(H2,12,13)
InChIKey
QFQQCSOIKYRSMA-UHFFFAOYSA-N
Compound name
1-(2-methylphenoxy)propan-2-yl carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

209.1052 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 210.11248 146.6
[M+Na]+ 232.09442 152.9
[M-H]- 208.09792 149.7
[M+NH4]+ 227.13902 164.9
[M+K]+ 248.06836 152.1
[M+H-H2O]+ 192.10246 140.1
[M+HCOO]- 254.10340 169.8
[M+CH3COO]- 268.11905 189.0
[M+Na-2H]- 230.07987 149.7
[M]+ 209.10465 148.1
[M]- 209.10575 148.1
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.