CID 105429943

1781313-58-3

Structural Information

Molecular Formula
C9H15NO
SMILES
C1C2CC(C1C=C2)(CN)CO
InChI
InChI=1S/C9H15NO/c10-5-9(6-11)4-7-1-2-8(9)3-7/h1-2,7-8,11H,3-6,10H2
InChIKey
QKNZOOQJIIDAGM-UHFFFAOYSA-N
Compound name
[2-(aminomethyl)-2-bicyclo[2.2.1]hept-5-enyl]methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

153.11537 Da
Monoisotopic Mass

0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 154.122646 133.9
[M+Na]+ 176.104588 141.5
[M-H]- 152.108094 135.3
[M+NH4]+ 171.149193 161.1
[M+K]+ 192.078528 138.6
[M+H-H2O]+ 136.112630 130.3
[M+HCOO]- 198.113571 155.8
[M+CH3COO]- 212.129221 175.4
[M+Na-2H]- 174.090036 138.9
[M]+ 153.11482142 131.7
[M]- 153.11591858 131.7
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.