CID 62707969

6-oxaspiro[2.5]octan-1-ylmethanamine

Structural Information

Molecular Formula
C8H15NO
SMILES
C1COCCC12CC2CN
InChI
InChI=1S/C8H15NO/c9-6-7-5-8(7)1-3-10-4-2-8/h7H,1-6,9H2
InChIKey
AZHAYPBYLOQJFW-UHFFFAOYSA-N
Compound name
6-oxaspiro[2.5]octan-2-ylmethanamine
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 130.0
[M+Na]+ 164.10459 137.5
[M-H]- 140.10809 136.6
[M+NH4]+ 159.14919 147.2
[M+K]+ 180.07853 137.6
[M+H-H2O]+ 124.11263 124.6
[M+HCOO]- 186.11357 150.2
[M+CH3COO]- 200.12922 177.5
[M+Na-2H]- 162.09004 138.1
[M]+ 141.11482 128.2
[M]- 141.11592 128.2
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.