CID 49510

67195-92-0

Structural Information

Molecular Formula
C13H20N2O2
SMILES
CCC(C)NCCOC(=O)NC1=CC=CC=C1
InChI
InChI=1S/C13H20N2O2/c1-3-11(2)14-9-10-17-13(16)15-12-7-5-4-6-8-12/h4-8,11,14H,3,9-10H2,1-2H3,(H,15,16)
InChIKey
FUJZOHBZONWEIW-UHFFFAOYSA-N
Compound name
2-(butan-2-ylamino)ethyl N-phenylcarbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

236.15248 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 237.15976 156.8
[M+Na]+ 259.14170 160.5
[M-H]- 235.14520 159.6
[M+NH4]+ 254.18630 173.7
[M+K]+ 275.11564 159.0
[M+H-H2O]+ 219.14974 149.3
[M+HCOO]- 281.15068 180.7
[M+CH3COO]- 295.16633 196.8
[M+Na-2H]- 257.12715 160.9
[M]+ 236.15193 157.3
[M]- 236.15303 157.3
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.