CID 53275727

6-oxaspiro[2.5]octan-1-amine hydrochloride

Structural Information

Molecular Formula
C7H13NO
SMILES
C1COCCC12CC2N
InChI
InChI=1S/C7H13NO/c8-6-5-7(6)1-3-9-4-2-7/h6H,1-5,8H2
InChIKey
DZKJNOMPBWITCE-UHFFFAOYSA-N
Compound name
6-oxaspiro[2.5]octan-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

42
Patents

127.09972 Da
Monoisotopic Mass

-0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 128.106996 125.9
[M+Na]+ 150.088938 133.8
[M-H]- 126.092444 132.6
[M+NH4]+ 145.133543 143.5
[M+K]+ 166.062878 134.0
[M+H-H2O]+ 110.096980 120.6
[M+HCOO]- 172.097921 146.3
[M+CH3COO]- 186.113571 174.6
[M+Na-2H]- 148.074386 134.5
[M]+ 127.09917142 123.7
[M]- 127.10026858 123.7
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

patents stripe