CID 97616691

6-methoxy-2-azaspiro[3.3]heptane hydrochloride

Structural Information

Molecular Formula
C7H13NO
SMILES
COC1CC2(C1)CNC2
InChI
InChI=1S/C7H13NO/c1-9-6-2-7(3-6)4-8-5-7/h6,8H,2-5H2,1H3
InChIKey
KLOVQWYQYLKOSU-UHFFFAOYSA-N
Compound name
6-methoxy-2-azaspiro[3.3]heptane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

102
Patents

127.09972 Da
Monoisotopic Mass

0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 128.10700 119.5
[M+Na]+ 150.08894 124.2
[M-H]- 126.09244 122.5
[M+NH4]+ 145.13354 128.5
[M+K]+ 166.06288 128.5
[M+H-H2O]+ 110.09698 106.5
[M+HCOO]- 172.09792 136.3
[M+CH3COO]- 186.11357 182.2
[M+Na-2H]- 148.07439 126.6
[M]+ 127.09917 133.2
[M]- 127.10027 133.2
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