CID 3975922

Cyclopropyl(2-methylphenyl)methanamine

Structural Information

Molecular Formula
C11H15N
SMILES
CC1=CC=CC=C1C(C2CC2)N
InChI
InChI=1S/C11H15N/c1-8-4-2-3-5-10(8)11(12)9-6-7-9/h2-5,9,11H,6-7,12H2,1H3
InChIKey
DIDFGEMIEMUSRJ-UHFFFAOYSA-N
Compound name
cyclopropyl-(2-methylphenyl)methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

13
Patents

161.12045 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 162.12773 131.3
[M+Na]+ 184.10967 139.7
[M-H]- 160.11317 138.6
[M+NH4]+ 179.15427 147.0
[M+K]+ 200.08361 136.7
[M+H-H2O]+ 144.11771 125.0
[M+HCOO]- 206.11865 155.4
[M+CH3COO]- 220.13430 185.2
[M+Na-2H]- 182.09512 136.9
[M]+ 161.11990 131.3
[M]- 161.12100 131.3
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