CID 43368167

2-methyl-3-phenoxypropan-1-amine hydrochloride

Structural Information

Molecular Formula
C10H15NO
SMILES
CC(CN)COC1=CC=CC=C1
InChI
InChI=1S/C10H15NO/c1-9(7-11)8-12-10-5-3-2-4-6-10/h2-6,9H,7-8,11H2,1H3
InChIKey
AOYPUDIEUCFIHX-UHFFFAOYSA-N
Compound name
2-methyl-3-phenoxypropan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

165.11537 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 166.122646 136.9
[M+Na]+ 188.104588 142.8
[M-H]- 164.108094 139.8
[M+NH4]+ 183.149193 156.9
[M+K]+ 204.078528 141.2
[M+H-H2O]+ 148.112630 130.7
[M+HCOO]- 210.113571 160.8
[M+CH3COO]- 224.129221 181.4
[M+Na-2H]- 186.090036 142.6
[M]+ 165.11482142 136.2
[M]- 165.11591858 136.2
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

patents stripe