CID 14403871

112257-19-9

Structural Information

Molecular Formula
C9H20N2O2
SMILES
CC(C)(C)OC(=O)N(C)CCNC
InChI
InChI=1S/C9H20N2O2/c1-9(2,3)13-8(12)11(5)7-6-10-4/h10H,6-7H2,1-5H3
InChIKey
DFVRUHANEXOZGT-UHFFFAOYSA-N
Compound name
tert-butyl N-methyl-N-[2-(methylamino)ethyl]carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1610
Patents

188.15248 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 189.15976 145.7
[M+Na]+ 211.14170 150.9
[M-H]- 187.14520 147.4
[M+NH4]+ 206.18630 165.9
[M+K]+ 227.11564 152.5
[M+H-H2O]+ 171.14974 140.3
[M+HCOO]- 233.15068 169.3
[M+CH3COO]- 247.16633 191.7
[M+Na-2H]- 209.12715 150.3
[M]+ 188.15193 148.6
[M]- 188.15303 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