CID 16790751

3-(naphthalen-2-yloxy)propan-1-amine hydrochloride

Structural Information

Molecular Formula
C13H15NO
SMILES
C1=CC=C2C=C(C=CC2=C1)OCCCN
InChI
InChI=1S/C13H15NO/c14-8-3-9-15-13-7-6-11-4-1-2-5-12(11)10-13/h1-2,4-7,10H,3,8-9,14H2
InChIKey
GGPOZDBJXGCCPA-UHFFFAOYSA-N
Compound name
3-naphthalen-2-yloxypropan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

41
Patents

201.11537 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 202.12265 143.4
[M+Na]+ 224.10459 150.6
[M-H]- 200.10809 147.2
[M+NH4]+ 219.14919 163.2
[M+K]+ 240.07853 147.0
[M+H-H2O]+ 184.11263 136.8
[M+HCOO]- 246.11357 167.2
[M+CH3COO]- 260.12922 188.1
[M+Na-2H]- 222.09004 151.4
[M]+ 201.11482 143.6
[M]- 201.11592 143.6
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

patents stripe