CID 132343787

2140316-76-1

Structural Information

Molecular Formula
C11H21N3O2
SMILES
CC(C)(C)OC(=O)N(C)CCC1=NCCN1
InChI
InChI=1S/C11H21N3O2/c1-11(2,3)16-10(15)14(4)8-5-9-12-6-7-13-9/h5-8H2,1-4H3,(H,12,13)
InChIKey
ZCFIUXXWRZMMQX-UHFFFAOYSA-N
Compound name
tert-butyl N-[2-(4,5-dihydro-1H-imidazol-2-yl)ethyl]-N-methylcarbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

227.16338 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 228.17066 155.9
[M+Na]+ 250.15260 160.7
[M-H]- 226.15610 156.4
[M+NH4]+ 245.19720 172.8
[M+K]+ 266.12654 160.5
[M+H-H2O]+ 210.16064 148.5
[M+HCOO]- 272.16158 174.6
[M+CH3COO]- 286.17723 191.1
[M+Na-2H]- 248.13805 158.5
[M]+ 227.16283 156.2
[M]- 227.16393 156.2
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.