CID 186315

Isopropyl n-(4-methoxyphenyl)carbamate

Structural Information

Molecular Formula
C11H15NO3
SMILES
CC(C)OC(=O)NC1=CC=C(C=C1)OC
InChI
InChI=1S/C11H15NO3/c1-8(2)15-11(13)12-9-4-6-10(14-3)7-5-9/h4-8H,1-3H3,(H,12,13)
InChIKey
CBGPYPHIFVEQTQ-UHFFFAOYSA-N
Compound name
propan-2-yl N-(4-methoxyphenyl)carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

8
References

6
Patents

209.1052 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 210.11248 146.2
[M+Na]+ 232.09442 152.5
[M-H]- 208.09792 149.9
[M+NH4]+ 227.13902 164.8
[M+K]+ 248.06836 152.1
[M+H-H2O]+ 192.10246 139.7
[M+HCOO]- 254.10340 170.0
[M+CH3COO]- 268.11905 189.0
[M+Na-2H]- 230.07987 150.4
[M]+ 209.10465 148.6
[M]- 209.10575 148.6
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe