CID 263103

Methyl[(2-methylphenyl)methyl]amine

Structural Information

Molecular Formula
C9H13N
SMILES
CC1=CC=CC=C1CNC
InChI
InChI=1S/C9H13N/c1-8-5-3-4-6-9(8)7-10-2/h3-6,10H,7H2,1-2H3
InChIKey
YMWQUYQBTXWNAH-UHFFFAOYSA-N
Compound name
N-methyl-1-(2-methylphenyl)methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

372
Patents

135.1048 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 136.11208 127.3
[M+Na]+ 158.09402 134.9
[M-H]- 134.09752 131.2
[M+NH4]+ 153.13862 149.3
[M+K]+ 174.06796 133.0
[M+H-H2O]+ 118.10206 121.8
[M+HCOO]- 180.10300 153.0
[M+CH3COO]- 194.11865 177.3
[M+Na-2H]- 156.07947 135.3
[M]+ 135.10425 126.9
[M]- 135.10535 126.9
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