CID 142914794

1-(3-ethyl-2-methylphenyl)methanamine hydrochloride

Structural Information

Molecular Formula
C10H15N
SMILES
CCC1=C(C(=CC=C1)CN)C
InChI
InChI=1S/C10H15N/c1-3-9-5-4-6-10(7-11)8(9)2/h4-6H,3,7,11H2,1-2H3
InChIKey
MRJSZRGAQHXSLT-UHFFFAOYSA-N
Compound name
(3-ethyl-2-methylphenyl)methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

149.12045 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 150.127726 132.2
[M+Na]+ 172.109668 140.3
[M-H]- 148.113174 135.8
[M+NH4]+ 167.154273 153.7
[M+K]+ 188.083608 137.8
[M+H-H2O]+ 132.117710 126.8
[M+HCOO]- 194.118651 156.9
[M+CH3COO]- 208.134301 180.8
[M+Na-2H]- 170.095116 137.8
[M]+ 149.11990142 131.5
[M]- 149.12099858 131.5
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

No patent data available for this compound.