CID 86230361

Bocnh-peg2-ch2ch2nhme

Structural Information

Molecular Formula
C12H26N2O4
SMILES
CC(C)(C)OC(=O)NCCOCCOCCNC
InChI
InChI=1S/C12H26N2O4/c1-12(2,3)18-11(15)14-6-8-17-10-9-16-7-5-13-4/h13H,5-10H2,1-4H3,(H,14,15)
InChIKey
FLNJYYUCKRLBCJ-UHFFFAOYSA-N
Compound name
tert-butyl N-[2-[2-[2-(methylamino)ethoxy]ethoxy]ethyl]carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

46
Patents

262.18927 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 263.19655 164.5
[M+Na]+ 285.17849 167.9
[M-H]- 261.18199 163.9
[M+NH4]+ 280.22309 180.8
[M+K]+ 301.15243 168.4
[M+H-H2O]+ 245.18653 158.0
[M+HCOO]- 307.18747 187.0
[M+CH3COO]- 321.20312 201.4
[M+Na-2H]- 283.16394 168.6
[M]+ 262.18872 170.1
[M]- 262.18982 170.1
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

patents stripe