CID 118001584

5-methyl-7-oxa-4-azaspiro[2.5]octane hydrochloride

Structural Information

Molecular Formula
C7H13NO
SMILES
CC1COCC2(N1)CC2
InChI
InChI=1S/C7H13NO/c1-6-4-9-5-7(8-6)2-3-7/h6,8H,2-5H2,1H3
InChIKey
PWQQNOBNZBTUHP-UHFFFAOYSA-N
Compound name
5-methyl-7-oxa-4-azaspiro[2.5]octane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

39
Patents

127.09972 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 128.106996 130.4
[M+Na]+ 150.088938 138.8
[M-H]- 126.092444 134.8
[M+NH4]+ 145.133543 146.7
[M+K]+ 166.062878 138.5
[M+H-H2O]+ 110.096980 124.5
[M+HCOO]- 172.097921 147.8
[M+CH3COO]- 186.113571 143.1
[M+Na-2H]- 148.074386 138.8
[M]+ 127.09917142 128.5
[M]- 127.10026858 128.5
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