CID 16738289

7-methoxy-5-azaspiro[2.4]heptane hydrochloride

Structural Information

Molecular Formula
C7H13NO
SMILES
COC1CNCC12CC2
InChI
InChI=1S/C7H13NO/c1-9-6-4-8-5-7(6)2-3-7/h6,8H,2-5H2,1H3
InChIKey
JCOXLNNECBLFQE-UHFFFAOYSA-N
Compound name
7-methoxy-5-azaspiro[2.4]heptane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

22
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 129.8
[M+Na]+ 150.088938 139.0
[M-H]- 126.092444 133.7
[M+NH4]+ 145.133543 149.0
[M+K]+ 166.062878 137.0
[M+H-H2O]+ 110.096980 124.5
[M+HCOO]- 172.097921 150.1
[M+CH3COO]- 186.113571 170.5
[M+Na-2H]- 148.074386 136.0
[M]+ 127.09917142 129.2
[M]- 127.10026858 129.2
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

patents stripe