CID 91759509

6-methyl-2-azaspiro[3.3]heptan-6-ol hydrochloride

Structural Information

Molecular Formula
C7H13NO
SMILES
CC1(CC2(C1)CNC2)O
InChI
InChI=1S/C7H13NO/c1-6(9)2-7(3-6)4-8-5-7/h8-9H,2-5H2,1H3
InChIKey
DIBKPCOOJLLKDM-UHFFFAOYSA-N
Compound name
6-methyl-2-azaspiro[3.3]heptan-6-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

71
Patents

127.09972 Da
Monoisotopic Mass

-0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 128.10700 125.5
[M+Na]+ 150.08894 130.6
[M-H]- 126.09244 127.8
[M+NH4]+ 145.13354 135.7
[M+K]+ 166.06288 133.9
[M+H-H2O]+ 110.09698 114.1
[M+HCOO]- 172.09792 140.8
[M+CH3COO]- 186.11357 179.7
[M+Na-2H]- 148.07439 132.6
[M]+ 127.09917 137.9
[M]- 127.10027 137.9
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