CID 155893992

{2-azabicyclo[2.2.1]heptan-4-yl}methanol

Structural Information

Molecular Formula
C7H13NO
SMILES
C1CC2(CC1NC2)CO
InChI
InChI=1S/C7H13NO/c9-5-7-2-1-6(3-7)8-4-7/h6,8-9H,1-5H2
InChIKey
SSGYWJKDARVKID-UHFFFAOYSA-N
Compound name
2-azabicyclo[2.2.1]heptan-4-ylmethanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
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 128.9
[M+Na]+ 150.08894 135.9
[M-H]- 126.09244 127.6
[M+NH4]+ 145.13354 155.3
[M+K]+ 166.06288 133.4
[M+H-H2O]+ 110.09698 124.7
[M+HCOO]- 172.09792 146.9
[M+CH3COO]- 186.11357 141.6
[M+Na-2H]- 148.07439 134.3
[M]+ 127.09917 124.6
[M]- 127.10027 124.6
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

No patent data available for this compound.