CID 105428296

2-{2-oxaspiro[3.3]heptan-6-yl}ethan-1-amine

Structural Information

Molecular Formula
C8H15NO
SMILES
C1C(CC12COC2)CCN
InChI
InChI=1S/C8H15NO/c9-2-1-7-3-8(4-7)5-10-6-8/h7H,1-6,9H2
InChIKey
YGFWVWMYCIVDMQ-UHFFFAOYSA-N
Compound name
2-(2-oxaspiro[3.3]heptan-6-yl)ethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

141.11537 Da
Monoisotopic Mass

0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 142.12265 121.5
[M+Na]+ 164.10459 125.0
[M-H]- 140.10809 126.9
[M+NH4]+ 159.14919 130.1
[M+K]+ 180.07853 130.8
[M+H-H2O]+ 124.11263 108.3
[M+HCOO]- 186.11357 139.9
[M+CH3COO]- 200.12922 188.4
[M+Na-2H]- 162.09004 128.8
[M]+ 141.11482 135.6
[M]- 141.11592 135.6
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.