CID 94037094

Rac-(1r,2s,4r)-2-(aminomethyl)bicyclo[2.2.1]hept-5-en-2-ol

Structural Information

Molecular Formula
C8H13NO
SMILES
C1[C@H]2C[C@@]([C@@H]1C=C2)(CN)O
InChI
InChI=1S/C8H13NO/c9-5-8(10)4-6-1-2-7(8)3-6/h1-2,6-7,10H,3-5,9H2/t6-,7+,8-/m0/s1
InChIKey
UIESWKMVBMPMGN-RNJXMRFFSA-N
Compound name
(1S,2R,4S)-2-(aminomethyl)bicyclo[2.2.1]hept-5-en-2-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

139.09972 Da
Monoisotopic Mass

-0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 140.10700 128.1
[M+Na]+ 162.08894 136.1
[M+NH4]+ 157.13354 138.9
[M+K]+ 178.06288 132.6
[M-H]- 138.09244 128.6
[M+Na-2H]- 160.07439 131.5
[M]+ 139.09917 129.2
[M]- 139.10027 129.2
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.