CID 132372740

2187426-49-7

Structural Information

Molecular Formula
C7H13NO
SMILES
C1C[C@@H]2C[C@@]2(NC1)CO
InChI
InChI=1S/C7H13NO/c9-5-7-4-6(7)2-1-3-8-7/h6,8-9H,1-5H2/t6-,7-/m1/s1
InChIKey
ITWKLSYEZRLYDF-RNFRBKRXSA-N
Compound name
[(1S,6R)-2-azabicyclo[4.1.0]heptan-1-yl]methanol
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 129.4
[M+Na]+ 150.08894 141.2
[M+NH4]+ 145.13354 140.2
[M+K]+ 166.06288 135.1
[M-H]- 126.09244 137.1
[M+Na-2H]- 148.07439 137.3
[M]+ 127.09917 134.4
[M]- 127.10027 134.4
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.