CID 6483887

(2-methoxynaphthalen-1-yl)methanamine

Structural Information

Molecular Formula
C12H13NO
SMILES
COC1=C(C2=CC=CC=C2C=C1)CN
InChI
InChI=1S/C12H13NO/c1-14-12-7-6-9-4-2-3-5-10(9)11(12)8-13/h2-7H,8,13H2,1H3
InChIKey
REAOSNBEURFYOE-UHFFFAOYSA-N
Compound name
(2-methoxynaphthalen-1-yl)methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

25
Patents

187.09972 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 188.10700 138.8
[M+Na]+ 210.08894 147.5
[M-H]- 186.09244 143.3
[M+NH4]+ 205.13354 159.6
[M+K]+ 226.06288 144.2
[M+H-H2O]+ 170.09698 132.7
[M+HCOO]- 232.09792 163.0
[M+CH3COO]- 246.11357 186.3
[M+Na-2H]- 208.07439 146.7
[M]+ 187.09917 139.1
[M]- 187.10027 139.1
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