CID 15611187

[1-(2-methylphenyl)cyclopropyl]methanamine

Structural Information

Molecular Formula
C11H15N
SMILES
CC1=CC=CC=C1C2(CC2)CN
InChI
InChI=1S/C11H15N/c1-9-4-2-3-5-10(9)11(8-12)6-7-11/h2-5H,6-8,12H2,1H3
InChIKey
PSSGHGDRMZGMRG-UHFFFAOYSA-N
Compound name
[1-(2-methylphenyl)cyclopropyl]methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

9
Patents

161.12045 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 162.127726 132.5
[M+Na]+ 184.109668 141.9
[M-H]- 160.113174 140.1
[M+NH4]+ 179.154273 150.2
[M+K]+ 200.083608 139.4
[M+H-H2O]+ 144.117710 127.1
[M+HCOO]- 206.118651 157.2
[M+CH3COO]- 220.134301 184.0
[M+Na-2H]- 182.095116 140.1
[M]+ 161.11990142 133.5
[M]- 161.12099858 133.5
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