CID 122235340

1638765-05-5

Structural Information

Molecular Formula
C11H20N2O2
SMILES
CC(C)(C)OC(=O)NC12CC(C1)(C2)CN
InChI
InChI=1S/C11H20N2O2/c1-9(2,3)15-8(14)13-11-4-10(5-11,6-11)7-12/h4-7,12H2,1-3H3,(H,13,14)
InChIKey
UFBJOKMOUWUJNE-UHFFFAOYSA-N
Compound name
tert-butyl N-[3-(aminomethyl)-1-bicyclo[1.1.1]pentanyl]carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

22
Patents

212.15248 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 213.15976 172.3
[M+Na]+ 235.14170 166.7
[M+NH4]+ 230.18630 170.7
[M+K]+ 251.11564 164.8
[M-H]- 211.14520 164.5
[M+Na-2H]- 233.12715 166.6
[M]+ 212.15193 166.5
[M]- 212.15303 166.5
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