CID 155970408

2639448-68-1

Structural Information

Molecular Formula
C8H15NO
SMILES
COCC(C12CC(C1)C2)N
InChI
InChI=1S/C8H15NO/c1-10-5-7(9)8-2-6(3-8)4-8/h6-7H,2-5,9H2,1H3
InChIKey
UUBQFNWSTBBPSP-UHFFFAOYSA-N
Compound name
1-(1-bicyclo[1.1.1]pentanyl)-2-methoxyethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

141.11537 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 142.12265 150.2
[M+Na]+ 164.10459 152.4
[M-H]- 140.10809 152.6
[M+NH4]+ 159.14919 155.4
[M+K]+ 180.07853 159.2
[M+H-H2O]+ 124.11263 135.5
[M+HCOO]- 186.11357 163.0
[M+CH3COO]- 200.12922 207.0
[M+Na-2H]- 162.09004 155.0
[M]+ 141.11482 173.7
[M]- 141.11592 173.7
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.