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]+ 128.10700 120.9
[M+Na]+ 150.08894 126.5
[M-H]- 126.09244 124.4
[M+NH4]+ 145.13354 137.3
[M+K]+ 166.06288 129.0
[M+H-H2O]+ 110.09698 111.8
[M+HCOO]- 172.09792 138.9
[M+CH3COO]- 186.11357 169.9
[M+Na-2H]- 148.07439 127.8
[M]+ 127.09917 125.5
[M]- 127.10027 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