CID 130445134

7-methyl-5-oxa-2-azaspiro[3.4]octane hydrochloride

Structural Information

Molecular Formula
C7H13NO
SMILES
CC1CC2(CNC2)OC1
InChI
InChI=1S/C7H13NO/c1-6-2-7(9-3-6)4-8-5-7/h6,8H,2-5H2,1H3
InChIKey
NVIVNYNICWZMAA-UHFFFAOYSA-N
Compound name
7-methyl-5-oxa-2-azaspiro[3.4]octane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

12
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 120.9
[M+Na]+ 150.088938 126.5
[M-H]- 126.092444 124.4
[M+NH4]+ 145.133543 137.3
[M+K]+ 166.062878 129.0
[M+H-H2O]+ 110.096980 111.8
[M+HCOO]- 172.097921 138.9
[M+CH3COO]- 186.113571 169.9
[M+Na-2H]- 148.074386 127.8
[M]+ 127.09917142 125.5
[M]- 127.10026858 125.5
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