CID 52146955

1-methyl-2-((2-methylphenoxy)methyl)benzene

Structural Information

Molecular Formula
C15H16O
SMILES
CC1=CC=CC=C1COC2=CC=CC=C2C
InChI
InChI=1S/C15H16O/c1-12-7-3-5-9-14(12)11-16-15-10-6-4-8-13(15)2/h3-10H,11H2,1-2H3
InChIKey
JOUVYHGZWQZGDK-UHFFFAOYSA-N
Compound name
1-methyl-2-[(2-methylphenoxy)methyl]benzene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

24
Patents

212.12012 Da
Monoisotopic Mass

4.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 213.12740 146.9
[M+Na]+ 235.10934 155.0
[M-H]- 211.11284 153.9
[M+NH4]+ 230.15394 165.9
[M+K]+ 251.08328 151.5
[M+H-H2O]+ 195.11738 139.8
[M+HCOO]- 257.11832 171.3
[M+CH3COO]- 271.13397 189.4
[M+Na-2H]- 233.09479 153.1
[M]+ 212.11957 148.6
[M]- 212.12067 148.6
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