CID 4720410

N-[(2-methoxyphenyl)methyl]cyclopropanamine

Structural Information

Molecular Formula
C11H15NO
SMILES
COC1=CC=CC=C1CNC2CC2
InChI
InChI=1S/C11H15NO/c1-13-11-5-3-2-4-9(11)8-12-10-6-7-10/h2-5,10,12H,6-8H2,1H3
InChIKey
GOOPSPCKQDXAKN-UHFFFAOYSA-N
Compound name
N-[(2-methoxyphenyl)methyl]cyclopropanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

41
Patents

177.11537 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 178.122646 135.7
[M+Na]+ 200.104588 144.3
[M-H]- 176.108094 143.4
[M+NH4]+ 195.149193 151.0
[M+K]+ 216.078528 141.5
[M+H-H2O]+ 160.112630 128.9
[M+HCOO]- 222.113571 161.5
[M+CH3COO]- 236.129221 187.0
[M+Na-2H]- 198.090036 143.2
[M]+ 177.11482142 138.6
[M]- 177.11591858 138.6
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