CID 43196595

N-(1-cyclopropylethyl)-4-methoxyaniline

Structural Information

Molecular Formula
C12H17NO
SMILES
CC(C1CC1)NC2=CC=C(C=C2)OC
InChI
InChI=1S/C12H17NO/c1-9(10-3-4-10)13-11-5-7-12(14-2)8-6-11/h5-10,13H,3-4H2,1-2H3
InChIKey
RUKUPEYUUFJAQX-UHFFFAOYSA-N
Compound name
N-(1-cyclopropylethyl)-4-methoxyaniline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

191.13101 Da
Monoisotopic Mass

3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 192.13829 139.8
[M+Na]+ 214.12023 147.7
[M-H]- 190.12373 147.3
[M+NH4]+ 209.16483 154.4
[M+K]+ 230.09417 145.1
[M+H-H2O]+ 174.12827 133.0
[M+HCOO]- 236.12921 164.3
[M+CH3COO]- 250.14486 190.7
[M+Na-2H]- 212.10568 145.6
[M]+ 191.13046 142.4
[M]- 191.13156 142.4
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.