CID 65497519

2-{1-[(tert-butoxy)methyl]cyclopropyl}ethan-1-amine

Structural Information

Molecular Formula
C10H21NO
SMILES
CC(C)(C)OCC1(CC1)CCN
InChI
InChI=1S/C10H21NO/c1-9(2,3)12-8-10(4-5-10)6-7-11/h4-8,11H2,1-3H3
InChIKey
DHLVMYSCZIBDGF-UHFFFAOYSA-N
Compound name
2-[1-[(2-methylpropan-2-yl)oxymethyl]cyclopropyl]ethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

171.16231 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 172.169586 140.5
[M+Na]+ 194.151528 148.4
[M-H]- 170.155034 144.7
[M+NH4]+ 189.196133 157.9
[M+K]+ 210.125468 147.2
[M+H-H2O]+ 154.159570 136.1
[M+HCOO]- 216.160511 162.2
[M+CH3COO]- 230.176161 186.2
[M+Na-2H]- 192.136976 147.2
[M]+ 171.16176142 144.1
[M]- 171.16285858 144.1
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

No patent data available for this compound.